#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k5t h ARG 28 N 0.00 0.32 0.01 0.54 -0.00 -2.02 -3.28 114.38 109.95 3k5t h ARG 28 Ca 0.00 -0.37 -0.00 0.00 -0.00 0.00 0.00 59.98 59.61 3k5t h ARG 28 Cb 0.00 0.11 0.00 0.00 -0.00 0.00 0.00 29.97 30.08 3k5t h ARG 28 CO 0.00 1.07 -0.01 1.57 -0.00 0.00 0.00 179.97 182.61 3k5t h LYS 29 N -0.27 -0.02 0.00 0.08 2.10 -2.01 -3.29 116.57 113.17 3k5t h LYS 29 Ca -0.07 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.58 3k5t h LYS 29 Cb 1.27 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.60 3k5t h LYS 29 CO 0.10 0.28 0.00 0.00 -2.00 0.00 0.00 179.45 177.83 3k5t n ALA 30 N -2.25 1.41 -0.02 0.07 0.00 -1.26 -2.88 120.51 115.58 3k5t n ALA 30 Ca -0.08 0.04 0.23 0.00 0.00 0.00 0.00 53.44 53.64 3k5t n ALA 30 Cb 0.17 -1.24 0.72 0.00 0.00 0.00 0.00 19.45 19.10 3k5t n ALA 30 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3k5t h GLY 31 N 1.46 0.00 1.63 0.00 0.00 -1.63 -0.28 103.07 104.25 3k5t h GLY 31 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.28 3k5t h GLY 31 CO 0.00 0.00 -0.03 -0.24 0.00 0.00 0.00 176.54 176.27 3k5t h VAL 32 N 0.00 1.19 -0.23 4.60 3.04 -1.80 -2.81 116.25 120.25 3k5t h VAL 32 Ca 0.29 -0.78 0.00 0.00 -1.01 0.00 0.00 66.70 65.20 3k5t h VAL 32 Cb 1.35 1.01 0.00 0.00 -2.01 0.00 0.00 31.29 31.64 3k5t h VAL 32 CO -0.00 0.26 0.00 0.49 -1.01 0.00 0.00 177.57 177.31 3k5t n PHE 33 N -4.28 0.30 -3.15 3.17 3.72 -0.12 -4.85 117.46 112.24 3k5t n PHE 33 Ca 0.01 -0.15 -0.39 0.00 -0.05 0.00 0.00 57.45 56.87 3k5t n PHE 33 Cb 0.25 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 38.73 3k5t n PHE 33 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 3k5t s SER 34 N -1.38 7.18 1.03 4.37 1.04 -1.06 -4.59 113.70 120.29 3k5t s SER 34 Ca 0.30 1.41 -0.12 0.00 0.48 0.00 0.00 55.95 58.02 3k5t s SER 34 Cb 0.16 -2.41 0.21 0.00 0.10 0.00 0.00 66.02 64.07 3k5t s SER 34 CO 0.23 0.23 1.08 -1.81 0.98 0.00 0.00 173.24 173.94 3k5t s ASP 35 N -1.18 2.13 0.15 7.02 1.01 -1.26 -4.93 116.67 119.62 3k5t s ASP 35 Ca 0.33 1.67 -0.30 0.00 0.71 0.00 0.00 52.55 54.95 3k5t s ASP 35 Cb -0.21 -2.32 -0.07 0.00 1.01 0.00 0.00 42.92 41.33 3k5t s ASP 35 CO 0.22 -3.51 1.15 -0.76 0.21 0.00 0.00 175.17 172.48 3k5t s LEU 36 N -6.79 4.45 0.84 1.23 1.43 -1.26 -5.00 118.68 113.58 3k5t s LEU 36 Ca 0.67 2.12 -0.10 0.00 -1.03 0.00 0.00 54.13 55.78 3k5t s LEU 36 Cb -0.22 -3.60 0.10 0.00 0.03 0.00 0.00 46.19 42.50 3k5t s LEU 36 CO 0.61 -0.32 1.12 -0.94 0.23 0.00 0.00 176.35 177.04 3k5t s SER 37 N 0.22 3.75 0.20 2.29 1.04 -1.26 -4.69 113.70 115.25 3k5t s SER 37 Ca 0.52 2.00 -0.16 0.00 0.48 0.00 0.00 55.95 58.79 3k5t s SER 37 Cb -0.30 -2.54 0.20 0.00 0.10 0.00 0.00 66.02 63.47 3k5t s SER 37 CO 0.34 -2.54 1.61 -1.13 0.98 0.00 0.00 173.24 172.49 3k5t h ASN 38 N -1.48 -0.84 -0.62 7.02 -1.24 -1.95 0.32 115.58 116.78 3k5t h ASN 38 Ca -0.43 0.21 0.05 0.00 0.71 0.00 0.00 56.30 56.84 3k5t h ASN 38 Cb 1.25 0.48 -0.05 0.00 0.73 0.00 0.00 38.32 40.72 3k5t h ASN 38 CO 0.47 -0.26 0.34 1.56 -1.29 0.00 0.00 177.43 178.24 3k5t h GLN 39 N -0.08 0.61 -0.74 6.67 1.08 -1.96 0.03 115.11 120.73 3k5t h GLN 39 Ca 0.28 -0.04 -0.05 0.00 -1.45 0.00 0.00 58.65 57.39 3k5t h GLN 39 Cb 0.52 -0.14 -0.03 0.00 -0.05 0.00 0.00 27.48 27.78 3k5t h GLN 39 CO -0.67 0.41 0.26 0.93 -0.95 0.00 0.00 178.83 178.80 3k5t h GLU 40 N 0.63 1.12 -0.27 1.46 5.08 -1.65 0.33 114.58 121.28 3k5t h GLU 40 Ca 0.28 -0.23 -0.05 0.00 -1.00 0.00 0.00 59.36 58.36 3k5t h GLU 40 Cb 0.17 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 3k5t h GLU 40 CO -0.17 0.94 -0.03 -0.07 -1.00 0.00 0.00 179.01 178.68 3k5t h LEU 41 N 1.08 0.50 -1.00 1.33 3.38 -0.45 -1.77 115.31 118.38 3k5t h LEU 41 Ca 0.24 -0.34 0.06 0.00 0.09 0.00 0.00 57.88 57.93 3k5t h LEU 41 Cb 0.26 -0.14 -0.06 0.00 0.09 0.00 0.00 40.66 40.81 3k5t h LEU 41 CO -0.01 0.72 0.65 0.11 0.09 0.00 0.00 178.44 180.00 3k5t h LYS 42 N 0.27 1.17 0.45 1.13 1.57 -0.82 -1.54 116.57 118.80 3k5t h LYS 42 Ca 0.07 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 3k5t h LYS 42 Cb 0.48 -0.26 0.00 0.00 0.08 0.00 0.00 32.23 32.54 3k5t h LYS 42 CO 0.02 0.77 -0.22 0.00 -0.57 0.00 0.00 179.45 179.46 3k5t h ALA 43 N 1.44 -0.60 -0.87 3.86 0.00 -0.61 -0.02 119.26 122.46 3k5t h ALA 43 Ca 0.42 -0.17 0.11 0.00 0.00 0.00 0.00 54.91 55.27 3k5t h ALA 43 Cb 0.12 0.23 -0.06 0.00 0.00 0.00 0.00 17.79 18.08 3k5t h ALA 43 CO -0.16 -0.77 0.56 0.28 0.00 0.00 0.00 179.25 179.16 3k5t h VAL 44 N -0.74 0.93 0.00 0.00 2.07 -1.25 -0.13 116.25 117.13 3k5t h VAL 44 Ca -0.06 -0.28 -0.00 0.00 0.82 0.00 0.00 66.70 67.18 3k5t h VAL 44 Cb 0.53 0.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.36 3k5t h VAL 44 CO 0.10 0.15 -0.00 -0.74 0.02 0.00 0.00 177.57 177.10 3k5t h HIS 45 N 0.81 -0.00 -0.55 1.57 6.17 -1.05 -1.57 115.15 120.53 3k5t h HIS 45 Ca 0.41 -0.00 0.04 0.00 0.71 0.00 0.00 60.37 61.53 3k5t h HIS 45 Cb 0.49 0.00 -0.04 0.00 2.52 0.00 0.00 27.41 30.37 3k5t h HIS 45 CO -0.00 0.36 0.30 0.77 0.71 0.00 0.00 177.93 180.06 3k5t h SER 46 N -0.36 0.44 0.00 3.26 0.02 -0.58 0.16 113.55 116.50 3k5t h SER 46 Ca -0.00 0.02 0.03 0.00 -0.84 0.00 0.00 61.79 61.00 3k5t h SER 46 Cb 0.36 -0.07 -0.05 0.00 0.14 0.00 0.00 62.40 62.78 3k5t h SER 46 CO 0.00 0.30 -0.32 0.15 -1.14 0.00 0.00 176.83 175.82 3k5t h PHE 47 N 0.57 -0.89 -0.29 3.45 3.57 -0.95 0.20 116.94 122.60 3k5t h PHE 47 Ca 0.24 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.70 3k5t h PHE 47 Cb 0.11 0.39 -0.02 0.00 2.79 0.00 0.00 35.95 39.23 3k5t h PHE 47 CO -0.09 -0.42 -0.09 -0.07 -2.23 0.00 0.00 178.31 175.42 3k5t h LEU 48 N -0.48 0.46 -1.32 0.59 3.38 -1.00 -2.25 115.31 114.69 3k5t h LEU 48 Ca 0.06 -0.11 -0.07 0.00 0.09 0.00 0.00 57.88 57.85 3k5t h LEU 48 Cb 0.56 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 3k5t h LEU 48 CO -0.27 0.60 -0.32 -0.50 0.09 0.00 0.00 178.44 178.05 3k5t h TRP 49 N 0.45 0.00 0.00 1.13 -0.00 -0.12 -2.95 115.95 114.46 3k5t h TRP 49 Ca 0.09 0.00 -0.04 0.00 -0.00 0.00 0.00 58.89 58.94 3k5t h TRP 49 Cb 0.44 0.00 -0.01 0.00 -0.00 0.00 0.00 29.16 29.59 3k5t h TRP 49 CO 0.01 0.32 -0.17 0.66 -0.00 0.00 0.00 178.44 179.26 3k5t h SER 50 N 0.00 0.00 -1.59 -3.49 4.64 0.01 -3.38 113.55 109.74 3k5t h SER 50 Ca -0.00 0.00 -0.59 0.00 -0.47 0.00 0.00 61.79 60.73 3k5t h SER 50 Cb 0.65 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 62.64 3k5t h SER 50 CO 0.04 0.17 1.31 -0.54 -0.87 0.00 0.00 176.83 176.94 3k5t s LYS 51 N -3.63 3.46 0.44 4.77 1.02 -1.12 -4.86 119.74 119.82 3k5t s LYS 51 Ca 0.01 -0.88 0.14 0.00 0.02 0.00 0.00 55.97 55.26 3k5t s LYS 51 Cb 0.10 -4.96 0.99 0.00 -0.52 0.00 0.00 37.83 33.44 3k5t s LYS 51 CO 0.62 -2.16 1.99 1.57 -0.92 0.00 0.00 175.35 176.45 3k5t h LYS 52 N 9.81 0.02 0.00 1.68 5.09 -1.85 -2.29 116.57 129.03 3k5t h LYS 52 Ca 0.04 -0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.78 3k5t h LYS 52 Cb 1.02 -0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.35 3k5t h LYS 52 CO 1.36 0.20 0.00 1.05 -2.09 0.00 0.00 179.45 179.97 3k5t h GLU 53 N 0.02 0.00 0.00 0.07 9.09 -1.95 0.13 114.58 121.95 3k5t h GLU 53 Ca 0.00 0.00 -0.06 0.00 0.05 0.00 0.00 59.36 59.35 3k5t h GLU 53 Cb 0.32 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.41 3k5t h GLU 53 CO 0.02 0.00 -0.31 -0.07 0.05 0.00 0.00 179.01 178.70 3k5t h LEU 54 N 0.00 0.00 -1.01 3.06 3.38 -1.75 -3.47 115.31 115.51 3k5t h LEU 54 Ca 0.00 0.00 -0.45 0.00 0.09 0.00 0.00 57.88 57.52 3k5t h LEU 54 Cb 0.17 0.00 0.02 0.00 0.09 0.00 0.00 40.66 40.93 3k5t h LEU 54 CO 0.00 0.31 -0.74 -2.11 0.09 0.00 0.00 178.44 175.98 3k5t n ARG 55 N -3.60 -6.14 -2.12 1.13 -4.01 0.03 -4.78 116.66 97.18 3k5t n ARG 55 Ca -0.01 0.66 -0.37 0.00 -1.04 0.00 0.00 57.85 57.09 3k5t n ARG 55 Cb 0.44 -5.58 0.01 0.00 -3.04 0.00 0.00 32.46 24.29 3k5t n ARG 55 CO 0.00 0.00 0.00 -0.51 -3.04 0.00 0.00 177.63 174.08 3k5t s LEU 56 N -7.24 3.94 0.09 2.89 1.43 -1.26 -4.41 118.68 114.13 3k5t s LEU 56 Ca 0.59 2.43 0.05 0.00 -1.03 0.00 0.00 54.13 56.17 3k5t s LEU 56 Cb -0.29 -4.28 -0.03 0.00 0.03 0.00 0.00 46.19 41.62 3k5t s LEU 56 CO 0.80 -1.14 -0.12 -1.10 0.23 0.00 0.00 176.35 175.02 3k5t s GLN 57 N -2.80 0.88 0.64 1.70 -0.21 0.24 -5.00 119.66 115.11 3k5t s GLN 57 Ca 0.67 -1.10 -0.18 0.00 0.02 0.00 0.00 55.36 54.76 3k5t s GLN 57 Cb -0.32 -0.72 -0.01 0.00 1.00 0.00 0.00 33.01 32.97 3k5t s GLN 57 CO 0.38 0.14 1.26 -2.14 -2.12 0.00 0.00 175.29 172.80 3k5t s PRO 58 N -2.40 2.61 0.61 2.91 0.02 -1.26 -4.47 135.00 133.03 3k5t s PRO 58 Ca 0.04 1.95 0.31 0.00 0.02 0.00 0.00 61.00 63.32 3k5t s PRO 58 Cb -0.06 -1.87 1.77 0.00 0.02 0.00 0.00 34.50 34.36 3k5t s PRO 58 CO 0.02 -1.52 2.13 0.66 -0.33 0.00 0.00 177.00 177.96 3k5t h SER 59 N 0.52 0.00 0.91 2.53 4.64 -1.89 -2.26 113.55 118.00 3k5t h SER 59 Ca -0.50 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 60.78 3k5t h SER 59 Cb 1.32 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.40 3k5t h SER 59 CO 0.53 0.00 -0.19 0.77 -0.87 0.00 0.00 176.83 177.07 3k5t h SER 60 N 0.00 0.00 -1.83 4.97 4.64 -1.93 -3.40 113.55 116.00 3k5t h SER 60 Ca 0.06 0.00 -0.66 0.00 -0.47 0.00 0.00 61.79 60.72 3k5t h SER 60 Cb 0.41 0.00 0.09 0.00 -0.31 0.00 0.00 62.40 62.58 3k5t h SER 60 CO -0.00 0.19 0.13 0.41 -0.87 0.00 0.00 176.83 176.69 3k5t n THR 61 N -3.36 1.13 -1.01 2.95 -1.04 -0.85 -4.83 114.28 107.26 3k5t n THR 61 Ca 0.00 -0.28 -0.15 0.00 -2.04 0.00 0.00 64.05 61.58 3k5t n THR 61 Cb 0.40 -0.69 -0.06 0.00 -1.82 0.00 0.00 70.33 68.15 3k5t n THR 61 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 3k5t n THR 62 N 1.12 2.84 -3.81 12.58 -2.24 -1.26 -4.82 114.28 118.69 3k5t n THR 62 Ca 0.15 -1.73 -0.12 0.00 -2.27 0.00 0.00 64.05 60.08 3k5t n THR 62 Cb 0.24 -1.66 -0.10 0.00 -2.10 0.00 0.00 70.33 66.72 3k5t n THR 62 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 3k5t s THR 63 N -0.74 0.05 -0.19 4.28 -1.32 -1.26 -5.00 115.64 111.47 3k5t s THR 63 Ca 0.44 -0.45 0.16 0.00 -1.21 0.00 0.00 61.69 60.63 3k5t s THR 63 Cb 0.26 -0.49 0.10 0.00 -1.51 0.00 0.00 72.50 70.86 3k5t s THR 63 CO -0.06 -0.25 1.47 0.24 -2.21 0.00 0.00 174.62 173.81 3k5t h MET 64 N 4.44 0.00 -4.02 7.08 0.00 -1.88 -3.40 114.93 117.15 3k5t h MET 64 Ca -0.29 0.00 -0.57 0.00 0.00 0.00 0.00 59.70 58.84 3k5t h MET 64 Cb 1.19 0.00 0.03 0.00 0.00 0.00 0.00 31.60 32.81 3k5t h MET 64 CO 0.39 0.44 2.56 0.00 0.00 0.00 0.00 176.91 180.30 3k5t n ALA 65 N -2.21 4.20 -3.41 6.32 0.00 -1.21 -4.53 120.51 119.67 3k5t n ALA 65 Ca 0.02 -2.94 -0.13 0.00 0.00 0.00 0.00 53.44 50.39 3k5t n ALA 65 Cb 0.70 -3.40 -0.09 0.00 0.00 0.00 0.00 19.45 16.66 3k5t n ALA 65 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 3k5t s LYS 66 N 4.16 0.60 -0.24 0.00 -2.85 -1.26 -4.45 119.74 115.70 3k5t s LYS 66 Ca 0.51 0.70 -0.17 0.00 -1.00 0.00 0.00 55.97 56.01 3k5t s LYS 66 Cb 0.13 0.29 -0.03 0.00 -2.06 0.00 0.00 37.83 36.16 3k5t s LYS 66 CO 0.04 -0.07 0.44 -0.80 0.10 0.00 0.00 175.35 175.06 3k5t s ASN 67 N 0.24 6.40 0.03 0.03 0.01 -1.26 -1.35 114.94 119.04 3k5t s ASN 67 Ca -0.00 0.48 -0.01 0.00 -0.71 0.00 0.00 52.86 52.61 3k5t s ASN 67 Cb -0.04 -2.25 -0.03 0.00 0.41 0.00 0.00 41.25 39.35 3k5t s ASN 67 CO 0.01 -0.18 -0.01 0.28 -1.51 0.00 0.00 177.10 175.69 3k5t s THR 68 N 1.86 0.16 -0.46 1.60 -1.32 -0.11 -0.60 115.64 116.78 3k5t s THR 68 Ca 0.19 -1.28 -0.21 0.00 -1.21 0.00 0.00 61.69 59.18 3k5t s THR 68 Cb -0.15 -0.86 0.03 0.00 -1.51 0.00 0.00 72.50 70.01 3k5t s THR 68 CO 0.09 -0.71 0.69 -0.69 -2.21 0.00 0.00 174.62 171.79 3k5t s VAL 69 N -2.61 4.77 -0.08 5.08 1.01 -1.26 -0.62 120.40 126.69 3k5t s VAL 69 Ca -0.05 0.09 0.03 0.00 0.00 0.00 0.00 61.98 62.05 3k5t s VAL 69 Cb -0.01 -4.26 -0.25 0.00 0.00 0.00 0.00 36.38 31.86 3k5t s VAL 69 CO -0.05 -0.68 0.51 0.33 0.00 0.00 0.00 175.10 175.20 3k5t n PHE 70 N 6.41 1.13 -3.80 5.22 7.35 0.27 -4.67 117.46 129.37 3k5t n PHE 70 Ca -0.01 0.31 -0.13 0.00 -0.76 0.00 0.00 57.45 56.86 3k5t n PHE 70 Cb 0.48 -1.17 -0.12 0.00 0.35 0.00 0.00 39.48 39.01 3k5t n PHE 70 CO 0.00 0.00 0.00 -1.17 -0.76 0.00 0.00 176.76 174.83 3k5t s LEU 71 N -6.57 1.18 -0.05 -2.13 2.96 -1.14 0.78 118.68 113.70 3k5t s LEU 71 Ca -0.14 0.37 0.01 0.00 -0.22 0.00 0.00 54.13 54.16 3k5t s LEU 71 Cb 0.07 0.61 0.02 0.00 0.50 0.00 0.00 46.19 47.40 3k5t s LEU 71 CO 0.80 -0.08 -0.04 -0.63 -1.32 0.00 0.00 176.35 175.08 3k5t s ILE 72 N 0.29 0.51 0.20 6.68 1.01 -0.67 -0.90 121.20 128.32 3k5t s ILE 72 Ca -0.02 -0.10 -0.13 0.00 0.00 0.00 0.00 60.65 60.41 3k5t s ILE 72 Cb -0.03 -0.55 0.00 0.00 0.01 0.00 0.00 42.46 41.89 3k5t s ILE 72 CO -0.01 0.22 0.42 -1.83 0.00 0.00 0.00 174.94 173.75 3k5t s GLU 73 N 0.99 1.36 0.01 2.79 -1.05 -0.87 -4.17 118.70 117.76 3k5t s GLU 73 Ca -0.10 -1.12 -0.30 0.00 -0.15 0.00 0.00 54.97 53.30 3k5t s GLU 73 Cb -0.14 0.45 -0.05 0.00 -0.44 0.00 0.00 34.13 33.95 3k5t s GLU 73 CO -0.00 -0.55 1.35 1.41 0.95 0.00 0.00 175.26 178.42 3k5t s MET 74 N -3.96 4.31 -0.56 -4.83 -2.45 -1.26 0.31 119.30 110.86 3k5t s MET 74 Ca 0.17 1.91 -0.18 0.00 -1.25 0.00 0.00 55.69 56.34 3k5t s MET 74 Cb 0.01 -3.52 0.11 0.00 1.25 0.00 0.00 34.83 32.67 3k5t s MET 74 CO 0.03 -0.52 0.61 -1.17 1.05 0.00 0.00 175.02 175.02 3k5t s LEU 75 N 2.15 5.65 0.23 4.11 2.96 0.16 -4.74 118.68 129.21 3k5t s LEU 75 Ca 0.62 -1.51 -0.31 0.00 -0.22 0.00 0.00 54.13 52.71 3k5t s LEU 75 Cb -0.31 -2.27 -0.14 0.00 0.50 0.00 0.00 46.19 43.97 3k5t s LEU 75 CO 0.26 -0.98 1.31 -0.11 -1.32 0.00 0.00 176.35 175.51 3k5t n LEU 76 N 5.88 2.62 -4.64 -0.68 7.94 -1.26 -4.28 117.00 122.58 3k5t n LEU 76 Ca -0.11 1.15 -0.29 0.00 -1.11 0.00 0.00 56.01 55.65 3k5t n LEU 76 Cb 0.42 -1.36 0.19 0.00 0.53 0.00 0.00 43.42 43.19 3k5t n LEU 76 CO 0.56 -0.76 0.62 -2.84 -1.11 0.00 0.00 177.39 173.86 3k5t s PRO 77 N -0.52 0.28 0.45 1.96 0.02 -1.26 -4.96 135.00 130.96 3k5t s PRO 77 Ca 0.68 0.68 -0.25 0.00 0.02 0.00 0.00 61.00 62.13 3k5t s PRO 77 Cb -0.70 -1.71 -0.08 0.00 0.02 0.00 0.00 34.50 32.03 3k5t s PRO 77 CO 0.51 -2.88 1.42 1.63 -0.33 0.00 0.00 177.00 177.36 3k5t n LYS 78 N -4.30 2.22 -0.17 5.54 5.02 -1.26 -4.84 118.16 120.37 3k5t n LYS 78 Ca 0.05 0.79 -0.01 0.00 -2.02 0.00 0.00 58.31 57.12 3k5t n LYS 78 Cb 0.56 -2.62 0.22 0.00 -0.02 0.00 0.00 35.03 33.17 3k5t n LYS 78 CO 0.00 0.00 0.00 -0.22 -0.52 0.00 0.00 177.40 176.66 3k5t h LYS 79 N 2.25 0.90 -0.06 1.97 3.64 -1.98 -1.17 116.57 122.11 3k5t h LYS 79 Ca -0.51 -0.12 0.04 0.00 -1.27 0.00 0.00 60.65 58.80 3k5t h LYS 79 Cb 1.27 -0.17 -0.05 0.00 -0.41 0.00 0.00 32.23 32.87 3k5t h LYS 79 CO 0.61 0.69 -0.29 -0.92 -2.27 0.00 0.00 179.45 177.27 3k5t h TYR 80 N 0.90 -0.78 -0.30 1.91 3.20 -1.99 0.20 116.97 120.10 3k5t h TYR 80 Ca 0.22 0.03 -0.13 0.00 3.14 0.00 0.00 58.73 61.99 3k5t h TYR 80 Cb 0.09 0.35 -0.01 0.00 1.54 0.00 0.00 36.73 38.71 3k5t h TYR 80 CO 0.01 -0.37 -0.33 0.45 -1.64 0.00 0.00 178.16 176.27 3k5t h HIS 81 N -0.40 0.76 -0.70 -3.82 3.86 -1.89 -2.23 115.15 110.72 3k5t h HIS 81 Ca 0.08 -0.20 -0.04 0.00 -1.16 0.00 0.00 60.37 59.04 3k5t h HIS 81 Cb 0.52 -0.17 -0.03 0.00 1.06 0.00 0.00 27.41 28.78 3k5t h HIS 81 CO -0.34 0.90 0.27 0.28 0.86 0.00 0.00 177.93 179.90 3k5t h VAL 82 N 0.55 1.25 -0.26 2.45 2.07 -0.76 -1.92 116.25 119.63 3k5t h VAL 82 Ca 0.06 -0.80 -0.14 0.00 0.82 0.00 0.00 66.70 66.64 3k5t h VAL 82 Cb 0.84 0.45 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 3k5t h VAL 82 CO 0.07 0.32 -0.42 -0.07 0.02 0.00 0.00 177.57 177.48 3k5t h LEU 83 N 1.01 0.67 -1.00 2.57 3.38 -0.49 -1.48 115.31 119.98 3k5t h LEU 83 Ca 0.23 -0.31 -0.07 0.00 0.09 0.00 0.00 57.88 57.82 3k5t h LEU 83 Cb 0.23 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 3k5t h LEU 83 CO -0.02 1.01 -0.03 0.03 0.09 0.00 0.00 178.44 179.52 3k5t h ARG 84 N 0.51 0.69 -0.54 1.13 3.08 -1.25 0.47 114.38 118.48 3k5t h ARG 84 Ca 0.04 -0.18 -0.11 0.00 0.07 0.00 0.00 59.98 59.79 3k5t h ARG 84 Cb 0.95 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.90 3k5t h ARG 84 CO 0.09 0.73 -0.10 0.35 -1.07 0.00 0.00 179.97 179.97 3k5t h PHE 85 N 0.65 1.12 0.13 3.04 3.57 -1.25 0.12 116.94 124.31 3k5t h PHE 85 Ca 0.13 -0.22 -0.29 0.00 3.53 0.00 0.00 57.97 61.11 3k5t h PHE 85 Cb 0.45 -0.28 0.00 0.00 2.79 0.00 0.00 35.95 38.91 3k5t h PHE 85 CO 0.02 1.03 -1.36 -0.07 -2.23 0.00 0.00 178.31 175.70 3k5t h LEU 86 N 0.90 0.43 0.00 0.59 3.38 -0.83 -3.36 115.31 116.42 3k5t h LEU 86 Ca 0.14 -0.50 -0.11 0.00 0.09 0.00 0.00 57.88 57.49 3k5t h LEU 86 Cb 0.66 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.25 3k5t h LEU 86 CO 0.05 1.40 -1.41 0.47 0.09 0.00 0.00 178.44 179.04 3k5t n ASP 87 N -3.51 2.31 -0.63 -0.43 8.00 0.16 -4.66 116.55 117.78 3k5t n ASP 87 Ca -0.12 0.01 0.05 0.00 0.71 0.00 0.00 54.79 55.44 3k5t n ASP 87 Cb 1.04 -0.15 0.14 0.00 -0.02 0.00 0.00 41.12 42.13 3k5t n ASP 87 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3k5t n LYS 88 N -2.95 1.82 -2.14 -1.24 4.76 -0.55 -4.91 118.16 112.94 3k5t n LYS 88 Ca -0.13 -1.16 -0.19 0.00 -2.87 0.00 0.00 58.31 53.96 3k5t n LYS 88 Cb 0.62 -1.30 -0.03 0.00 -1.84 0.00 0.00 35.03 32.48 3k5t n LYS 88 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3k5t n GLY 89 N 0.94 0.22 3.97 0.72 0.00 -0.61 -4.90 105.19 105.53 3k5t n GLY 89 Ca 0.11 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.86 3k5t n GLY 89 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3k5t s GLU 90 N -4.58 1.11 0.47 1.61 0.41 0.31 -4.95 118.70 113.08 3k5t s GLU 90 Ca 0.00 -0.84 -0.21 0.00 -0.41 0.00 0.00 54.97 53.51 3k5t s GLU 90 Cb 0.00 -2.10 -0.11 0.00 -1.78 0.00 0.00 34.13 30.14 3k5t s GLU 90 CO 0.00 -1.95 0.57 2.89 -0.49 0.00 0.00 175.26 176.28 3k5t n ARG 91 N -3.30 0.62 -2.06 1.61 0.00 -1.26 -4.41 116.66 107.86 3k5t n ARG 91 Ca 0.16 0.23 -0.42 0.00 -0.00 0.00 0.00 57.85 57.82 3k5t n ARG 91 Cb 0.60 -1.62 -0.03 0.00 -0.00 0.00 0.00 32.46 31.41 3k5t n ARG 91 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.63 176.62 3k5t s HIS 92 N -1.54 3.07 0.39 2.89 4.02 -1.26 -4.35 115.29 118.51 3k5t s HIS 92 Ca 0.65 0.76 -0.26 0.00 1.02 0.00 0.00 55.06 57.23 3k5t s HIS 92 Cb -0.54 -3.80 -0.09 0.00 -1.02 0.00 0.00 32.58 27.13 3k5t s HIS 92 CO 0.57 -2.93 1.27 -1.25 1.02 0.00 0.00 174.74 173.42 3k5t s PRO 93 N 1.34 4.05 0.35 8.40 0.04 -1.26 -4.93 135.00 142.98 3k5t s PRO 93 Ca 0.67 2.08 -0.28 0.00 0.04 0.00 0.00 61.00 63.52 3k5t s PRO 93 Cb -0.39 -2.79 -0.12 0.00 0.04 0.00 0.00 34.50 31.23 3k5t s PRO 93 CO 0.31 -0.40 1.23 0.28 0.04 0.00 0.00 177.00 178.46 3k5t n VAL 94 N 0.23 2.07 -3.74 -0.36 0.31 -1.26 -4.97 118.33 110.61 3k5t n VAL 94 Ca 0.03 -0.50 -0.37 0.00 -0.01 0.00 0.00 64.34 63.49 3k5t n VAL 94 Cb 0.44 -1.46 -0.06 0.00 -0.91 0.00 0.00 33.84 31.84 3k5t n VAL 94 CO 0.00 0.00 0.00 -0.60 -1.32 0.00 0.00 176.83 174.91 3k5t s ARG 95 N -1.87 3.76 -0.00 5.55 3.52 -1.26 -4.73 118.95 123.92 3k5t s ARG 95 Ca 0.57 -0.01 -0.00 0.00 -0.13 0.00 0.00 55.73 56.16 3k5t s ARG 95 Cb -0.58 -3.26 -0.00 0.00 -1.56 0.00 0.00 34.95 29.54 3k5t s ARG 95 CO 0.61 0.62 0.01 -1.21 -0.81 0.00 0.00 175.30 174.52 3k5t s GLU 96 N -0.63 0.06 0.08 5.12 2.02 -1.26 -0.79 118.70 123.30 3k5t s GLU 96 Ca 0.16 -0.08 -0.11 0.00 0.02 0.00 0.00 54.97 54.96 3k5t s GLU 96 Cb -0.13 0.02 -0.06 0.00 0.10 0.00 0.00 34.13 34.07 3k5t s GLU 96 CO 0.05 -0.01 0.42 0.00 0.02 0.00 0.00 175.26 175.74 3k5t s ALA 97 N -0.22 3.70 -0.06 5.21 0.00 0.16 0.40 121.76 130.95 3k5t s ALA 97 Ca -0.02 -0.33 -0.16 0.00 0.00 0.00 0.00 51.96 51.45 3k5t s ALA 97 Cb -0.02 -2.32 -0.05 0.00 0.00 0.00 0.00 23.12 20.73 3k5t s ALA 97 CO -0.00 0.54 0.42 0.50 0.00 0.00 0.00 175.76 177.22 3k5t s ARG 98 N -1.82 4.10 -0.23 0.00 3.52 0.15 -0.06 118.95 124.60 3k5t s ARG 98 Ca 0.33 0.39 -0.02 0.00 -0.13 0.00 0.00 55.73 56.30 3k5t s ARG 98 Cb -0.14 -3.31 0.07 0.00 -1.56 0.00 0.00 34.95 30.00 3k5t s ARG 98 CO 0.18 0.47 0.04 0.00 -0.81 0.00 0.00 175.30 175.17 3k5t s ALA 99 N -0.35 1.22 -0.46 6.12 0.00 0.29 -2.05 121.76 126.52 3k5t s ALA 99 Ca 0.24 -1.00 -0.23 0.00 0.00 0.00 0.00 51.96 50.96 3k5t s ALA 99 Cb -0.16 -1.31 0.03 0.00 0.00 0.00 0.00 23.12 21.68 3k5t s ALA 99 CO 0.11 -1.30 0.80 0.08 0.00 0.00 0.00 175.76 175.45 3k5t s VAL 100 N 1.76 4.63 -0.18 0.00 1.01 -0.08 -1.56 120.40 125.97 3k5t s VAL 100 Ca 0.01 0.37 -0.08 0.00 0.00 0.00 0.00 61.98 62.29 3k5t s VAL 100 Cb -0.17 -4.35 -0.04 0.00 0.00 0.00 0.00 36.38 31.82 3k5t s VAL 100 CO -0.12 -0.77 0.07 -0.63 0.00 0.00 0.00 175.10 173.65 3k5t s ILE 101 N 3.34 4.87 -0.18 2.22 1.01 -0.22 -0.57 121.20 131.68 3k5t s ILE 101 Ca 0.29 -0.00 -0.22 0.00 0.00 0.00 0.00 60.65 60.71 3k5t s ILE 101 Cb -0.12 -3.20 -0.02 0.00 0.01 0.00 0.00 42.46 39.12 3k5t s ILE 101 CO 0.22 0.46 0.70 -0.36 0.00 0.00 0.00 174.94 175.96 3k5t s PHE 102 N 0.37 3.41 -0.94 3.97 0.40 0.21 -1.77 117.98 123.63 3k5t s PHE 102 Ca 0.04 1.06 -0.00 0.00 -0.60 0.00 0.00 56.93 57.42 3k5t s PHE 102 Cb -0.12 -2.87 0.31 0.00 0.51 0.00 0.00 43.02 40.86 3k5t s PHE 102 CO -0.00 -0.17 1.50 1.19 0.70 0.00 0.00 175.22 178.44 3k5t n PHE 103 N 4.99 2.90 0.18 0.36 3.72 0.13 -0.93 117.46 128.81 3k5t n PHE 103 Ca 0.00 -2.93 0.03 0.00 -0.05 0.00 0.00 57.45 54.50 3k5t n PHE 103 Cb 0.50 -1.04 0.34 0.00 -0.94 0.00 0.00 39.48 38.33 3k5t n PHE 103 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 3k5t h GLY 104 N 4.35 0.00 -5.79 1.37 0.00 -1.43 -2.92 103.07 98.65 3k5t h GLY 104 Ca 0.35 0.00 -0.75 0.00 0.00 0.00 0.00 47.33 46.93 3k5t h GLY 104 CO 1.14 0.00 2.22 1.34 0.00 0.00 0.00 176.54 181.24 3k5t n ASP 105 N -3.83 7.70 -3.45 0.19 2.03 -1.23 -4.10 116.55 113.87 3k5t n ASP 105 Ca -0.01 -3.20 -0.11 0.00 0.52 0.00 0.00 54.79 51.99 3k5t n ASP 105 Cb 0.47 -1.35 -0.02 0.00 -0.72 0.00 0.00 41.12 39.50 3k5t n ASP 105 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3k5t s GLN 106 N -1.36 1.20 0.25 -0.67 -2.07 -1.26 -4.90 119.66 110.85 3k5t s GLN 106 Ca 0.51 -0.45 -0.11 0.00 -1.82 0.00 0.00 55.36 53.49 3k5t s GLN 106 Cb 0.18 0.55 0.35 0.00 -1.09 0.00 0.00 33.01 32.99 3k5t s GLN 106 CO -0.09 -0.52 1.58 1.05 -1.32 0.00 0.00 175.29 176.00 3k5t h GLU 107 N 2.00 -0.01 -3.59 9.60 4.11 -1.94 -3.21 114.58 121.53 3k5t h GLU 107 Ca -0.31 0.00 -0.68 0.00 0.07 0.00 0.00 59.36 58.44 3k5t h GLU 107 Cb 1.29 0.00 -0.37 0.00 0.50 0.00 0.00 28.75 30.17 3k5t h GLU 107 CO 0.36 -0.01 -0.46 -1.01 0.07 0.00 0.00 179.01 177.96 3k5t s HIS 108 N -6.22 3.36 0.60 2.06 3.76 -1.26 -5.09 115.29 112.49 3k5t s HIS 108 Ca -0.15 -2.86 -0.20 0.00 -0.15 0.00 0.00 55.06 51.71 3k5t s HIS 108 Cb 0.23 -3.08 -0.03 0.00 1.11 0.00 0.00 32.58 30.81 3k5t s HIS 108 CO 0.76 -0.82 1.27 -2.30 -0.85 0.00 0.00 174.74 172.79 3k5t n PRO 109 N 3.43 1.32 -3.92 8.40 -0.02 -1.22 -5.01 135.00 137.98 3k5t n PRO 109 Ca 0.06 0.50 -0.09 0.00 -2.02 0.00 0.00 63.50 61.95 3k5t n PRO 109 Cb 0.36 -2.49 -0.02 0.00 -0.02 0.00 0.00 33.50 31.34 3k5t n PRO 109 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3k5t s ASN 110 N -1.16 0.04 -0.11 2.55 2.20 -1.10 -4.47 114.94 112.90 3k5t s ASN 110 Ca 0.77 -0.98 -0.00 0.00 -0.94 0.00 0.00 52.86 51.70 3k5t s ASN 110 Cb -0.40 0.71 -0.02 0.00 -2.00 0.00 0.00 41.25 39.53 3k5t s ASN 110 CO 0.45 -1.38 -0.08 -0.69 -2.94 0.00 0.00 177.10 172.46 3k5t s VAL 111 N -3.38 3.53 0.06 3.54 1.01 -1.26 0.17 120.40 124.06 3k5t s VAL 111 Ca 0.18 -0.52 0.05 0.00 0.00 0.00 0.00 61.98 61.70 3k5t s VAL 111 Cb -0.03 -2.48 -0.03 0.00 0.00 0.00 0.00 36.38 33.84 3k5t s VAL 111 CO 0.11 0.55 -0.14 -0.89 0.00 0.00 0.00 175.10 174.73 3k5t s THR 112 N -0.17 1.07 0.21 3.92 2.01 -0.73 -4.96 115.64 116.99 3k5t s THR 112 Ca 0.02 -1.19 0.09 0.00 0.31 0.00 0.00 61.69 60.92 3k5t s THR 112 Cb -0.13 -1.02 -0.04 0.00 0.01 0.00 0.00 72.50 71.32 3k5t s THR 112 CO 0.03 -0.16 -0.07 -1.61 -0.69 0.00 0.00 174.62 172.12 3k5t s GLU 113 N -1.53 2.13 -0.10 4.92 2.02 -1.26 -1.05 118.70 123.82 3k5t s GLU 113 Ca -0.01 -1.34 -0.07 0.00 0.02 0.00 0.00 54.97 53.57 3k5t s GLU 113 Cb -0.09 -2.15 0.04 0.00 0.10 0.00 0.00 34.13 32.03 3k5t s GLU 113 CO 0.02 0.41 0.25 -0.06 0.02 0.00 0.00 175.26 175.89 3k5t s PHE 114 N -1.96 -0.31 -0.56 1.61 0.40 -0.60 -0.44 117.98 116.11 3k5t s PHE 114 Ca 0.27 0.74 -0.25 0.00 -0.60 0.00 0.00 56.93 57.10 3k5t s PHE 114 Cb -0.08 0.07 0.04 0.00 0.51 0.00 0.00 43.02 43.56 3k5t s PHE 114 CO 0.17 -0.19 0.99 0.00 0.70 0.00 0.00 175.22 176.89 3k5t s ALA 115 N 0.81 3.12 -0.27 5.36 0.00 0.03 -0.55 121.76 130.26 3k5t s ALA 115 Ca -0.06 -1.19 -0.11 0.00 0.00 0.00 0.00 51.96 50.60 3k5t s ALA 115 Cb -0.07 -3.80 -0.05 0.00 0.00 0.00 0.00 23.12 19.20 3k5t s ALA 115 CO -0.05 -2.46 0.21 0.08 0.00 0.00 0.00 175.76 173.53 3k5t s VAL 116 N 4.17 5.30 0.37 0.00 1.01 0.91 -0.88 120.40 131.27 3k5t s VAL 116 Ca 0.32 0.22 -0.16 0.00 0.00 0.00 0.00 61.98 62.36 3k5t s VAL 116 Cb -0.12 -3.54 0.06 0.00 0.00 0.00 0.00 36.38 32.78 3k5t s VAL 116 CO 0.20 0.26 0.83 -0.83 0.00 0.00 0.00 175.10 175.55 3k5t s GLY 117 N 1.63 0.37 0.53 4.51 0.00 -1.08 0.37 107.32 113.66 3k5t s GLY 117 Ca 0.08 -0.74 -0.07 0.00 0.00 0.00 0.00 44.72 43.99 3k5t s GLY 117 CO 0.10 0.05 0.88 2.56 0.00 0.00 0.00 173.10 176.68 3k5t s PRO 118 N -2.16 3.57 -0.15 2.90 0.04 -1.25 -0.63 135.00 137.32 3k5t s PRO 118 Ca 0.17 0.41 -0.02 0.00 0.04 0.00 0.00 61.00 61.59 3k5t s PRO 118 Cb -0.05 -2.27 -0.02 0.00 0.04 0.00 0.00 34.50 32.21 3k5t s PRO 118 CO 0.11 -0.34 -0.08 -0.51 0.04 0.00 0.00 177.00 176.23 3k5t s LEU 119 N -4.89 2.99 1.04 -3.56 1.43 0.03 -1.46 118.68 114.27 3k5t s LEU 119 Ca 0.50 -0.24 -0.13 0.00 -1.03 0.00 0.00 54.13 53.23 3k5t s LEU 119 Cb -0.11 -1.71 0.21 0.00 0.03 0.00 0.00 46.19 44.62 3k5t s LEU 119 CO 0.48 0.15 1.09 -2.16 0.23 0.00 0.00 176.35 176.14 3k5t s PRO 120 N 0.46 0.07 -0.37 1.29 0.04 -1.26 -4.28 135.00 130.95 3k5t s PRO 120 Ca -0.06 0.42 -0.01 0.00 0.04 0.00 0.00 61.00 61.39 3k5t s PRO 120 Cb -0.15 -1.70 -0.01 0.00 0.04 0.00 0.00 34.50 32.67 3k5t s PRO 120 CO 0.04 -2.95 0.34 0.41 0.04 0.00 0.00 177.00 174.87 3k5t n GLY 121 N -0.99 -0.38 3.74 0.56 0.00 -1.20 -4.97 105.19 101.94 3k5t n GLY 121 Ca 0.06 0.09 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 3k5t n GLY 121 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3k5t n PRO 122 N -1.72 2.55 0.00 1.61 -0.02 -0.53 -3.89 135.00 133.00 3k5t n PRO 122 Ca -0.01 0.90 0.00 0.00 -2.02 0.00 0.00 63.50 62.37 3k5t n PRO 122 Cb 0.52 -2.64 0.00 0.00 -0.02 0.00 0.00 33.50 31.36 3k5t n PRO 122 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3k5t s TYR 124 N -1.94 0.76 -0.18 0.00 -0.85 -0.42 -5.01 117.35 109.71 3k5t s TYR 124 Ca 0.00 -1.13 -0.03 0.00 -0.52 0.00 0.00 57.07 55.39 3k5t s TYR 124 Cb 0.00 -0.38 0.06 0.00 0.38 0.00 0.00 41.96 42.01 3k5t s TYR 124 CO 0.00 -0.57 0.04 0.00 -1.52 0.00 0.00 175.55 173.50 3k5t s MET 125 N -4.03 0.58 -0.31 -3.49 0.23 -1.26 -2.62 119.30 108.40 3k5t s MET 125 Ca 0.23 -0.32 -0.10 0.00 -1.03 0.00 0.00 55.69 54.46 3k5t s MET 125 Cb 0.06 -1.94 -0.02 0.00 -1.53 0.00 0.00 34.83 31.40 3k5t s MET 125 CO 0.01 -0.60 0.17 1.03 -2.03 0.00 0.00 175.02 173.60 3k5t s ARG 126 N 1.91 3.52 0.22 3.16 0.52 -0.06 -4.87 118.95 123.35 3k5t s ARG 126 Ca 0.00 -0.60 -0.32 0.00 -0.52 0.00 0.00 55.73 54.29 3k5t s ARG 126 Cb -0.16 -3.62 -0.12 0.00 0.52 0.00 0.00 34.95 31.57 3k5t s ARG 126 CO -0.08 -0.36 1.72 0.00 0.02 0.00 0.00 175.30 176.60 3k5t n ALA 127 N 5.02 2.84 -2.80 2.13 0.00 -1.26 -0.79 120.51 125.66 3k5t n ALA 127 Ca -0.14 0.40 -0.35 0.00 0.00 0.00 0.00 53.44 53.35 3k5t n ALA 127 Cb 0.50 -2.52 -0.09 0.00 0.00 0.00 0.00 19.45 17.34 3k5t n ALA 127 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3k5t s LEU 128 N 1.04 3.94 -0.69 0.00 1.02 0.41 -4.79 118.68 119.60 3k5t s LEU 128 Ca 0.74 0.14 -0.08 0.00 0.02 0.00 0.00 54.13 54.95 3k5t s LEU 128 Cb -0.50 -2.00 0.01 0.00 0.02 0.00 0.00 46.19 43.72 3k5t s LEU 128 CO 0.33 0.19 0.64 -1.54 0.02 0.00 0.00 176.35 176.00 3k5t n SER 129 N 3.44 -6.21 -4.73 2.29 3.41 -1.26 -4.54 113.62 106.02 3k5t n SER 129 Ca -0.17 -0.39 -0.36 0.00 -0.26 0.00 0.00 58.87 57.69 3k5t n SER 129 Cb 0.52 -3.21 0.08 0.00 -0.26 0.00 0.00 64.21 61.34 3k5t n SER 129 CO 0.00 0.00 0.00 -2.84 -0.16 0.00 0.00 175.04 172.04 3k5t s PRO 130 N -3.68 2.42 -0.48 4.33 0.02 -1.26 -5.00 135.00 131.34 3k5t s PRO 130 Ca 0.09 2.02 0.04 0.00 0.02 0.00 0.00 61.00 63.17 3k5t s PRO 130 Cb -0.01 -1.83 0.17 0.00 0.02 0.00 0.00 34.50 32.84 3k5t s PRO 130 CO 0.83 -1.69 0.38 -2.13 -0.33 0.00 0.00 177.00 174.06 3k5t n ARG 131 N -2.11 0.56 -2.04 5.54 0.63 -1.26 -5.12 116.66 112.85 3k5t n ARG 131 Ca 0.15 -3.47 -0.39 0.00 -0.92 0.00 0.00 57.85 53.23 3k5t n ARG 131 Cb 0.48 -1.81 0.00 0.00 0.45 0.00 0.00 32.46 31.59 3k5t n ARG 131 CO 0.00 0.00 0.00 -2.14 -2.51 0.00 0.00 177.63 172.98 3k5t s PRO 132 N -0.29 3.75 0.00 -0.14 0.02 -1.26 -2.83 135.00 134.24 3k5t s PRO 132 Ca 0.31 2.09 0.00 0.00 0.02 0.00 0.00 61.00 63.42 3k5t s PRO 132 Cb 0.02 -2.57 0.00 0.00 0.02 0.00 0.00 34.50 31.97 3k5t s PRO 132 CO -0.19 -0.65 0.00 0.41 -0.33 0.00 0.00 177.00 176.23 3k5t n GLY 133 N 0.62 2.97 3.72 0.52 0.00 -1.26 -5.04 105.19 106.72 3k5t n GLY 133 Ca 0.06 -0.78 -0.42 0.00 0.00 0.00 0.00 46.02 44.88 3k5t n GLY 133 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3k5t s TYR 134 N -1.01 3.45 -0.20 1.61 6.04 -1.13 -4.94 117.35 121.19 3k5t s TYR 134 Ca 0.00 1.35 0.07 0.00 0.04 0.00 0.00 57.07 58.52 3k5t s TYR 134 Cb 0.00 -3.40 -0.08 0.00 -1.04 0.00 0.00 41.96 37.43 3k5t s TYR 134 CO 0.00 -1.19 0.23 0.00 -1.54 0.00 0.00 175.55 173.04 3k5t n GLN 135 N 3.61 3.12 -1.30 4.97 -0.00 -1.26 -4.81 117.38 121.72 3k5t n GLN 135 Ca 0.08 -0.02 -0.28 0.00 -0.00 0.00 0.00 57.00 56.78 3k5t n GLN 135 Cb 0.46 -0.94 0.12 0.00 -0.00 0.00 0.00 30.24 29.89 3k5t n GLN 135 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.06 177.49 3k5t n SER 136 N -1.37 5.67 0.05 2.61 7.64 -1.26 -4.59 113.62 122.37 3k5t n SER 136 Ca 0.00 -3.72 -0.04 0.00 1.01 0.00 0.00 58.87 56.13 3k5t n SER 136 Cb 0.13 -0.86 0.19 0.00 -1.01 0.00 0.00 64.21 62.66 3k5t n SER 136 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 3k5t h SER 137 N 1.56 0.39 -0.39 6.43 4.64 -1.90 -2.70 113.55 121.59 3k5t h SER 137 Ca 0.58 -0.16 -0.09 0.00 -0.47 0.00 0.00 61.79 61.65 3k5t h SER 137 Cb 1.69 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 63.66 3k5t h SER 137 CO 1.27 0.73 -0.10 -0.25 -0.87 0.00 0.00 176.83 177.61 3k5t h TRP 138 N 0.33 0.85 0.00 4.77 2.91 -1.81 -2.78 115.95 120.21 3k5t h TRP 138 Ca 0.04 -0.19 0.00 0.00 1.13 0.00 0.00 58.89 59.87 3k5t h TRP 138 Cb 0.78 -0.21 0.00 0.00 -0.51 0.00 0.00 29.16 29.23 3k5t h TRP 138 CO 0.02 0.89 0.00 0.00 -1.03 0.00 0.00 178.44 178.33 3k5t h ALA 139 N 0.83 1.00 0.00 2.65 0.00 -1.88 -3.11 119.26 118.76 3k5t h ALA 139 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3k5t h ALA 139 Cb 0.62 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.41 3k5t h ALA 139 CO 0.04 0.00 -0.17 -1.13 0.00 0.00 0.00 179.25 177.99 3k5t n SER 140 N -2.71 0.57 -4.51 0.00 3.41 -1.02 -4.69 113.62 104.67 3k5t n SER 140 Ca 0.03 0.39 -0.41 0.00 -0.26 0.00 0.00 58.87 58.62 3k5t n SER 140 Cb 0.35 -0.44 0.01 0.00 -0.26 0.00 0.00 64.21 63.88 3k5t n SER 140 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3k5t n ARG 141 N -1.98 0.79 -1.43 4.33 1.74 -1.16 -4.35 116.66 114.60 3k5t n ARG 141 Ca 0.05 0.29 -0.33 0.00 -0.77 0.00 0.00 57.85 57.09 3k5t n ARG 141 Cb 0.40 -1.71 0.09 0.00 -1.02 0.00 0.00 32.46 30.23 3k5t n ARG 141 CO 0.00 0.00 0.00 -2.14 -1.52 0.00 0.00 177.63 173.97 3k5t s PRO 142 N -1.81 2.21 -0.05 5.56 0.02 -1.26 -4.82 135.00 134.85 3k5t s PRO 142 Ca 0.64 1.59 -0.28 0.00 0.02 0.00 0.00 61.00 62.97 3k5t s PRO 142 Cb -0.57 -1.86 -0.02 0.00 0.02 0.00 0.00 34.50 32.07 3k5t s PRO 142 CO 0.57 -1.74 0.93 -1.50 -0.33 0.00 0.00 177.00 174.92 3k5t s ILE 143 N -2.23 4.87 0.51 2.83 2.07 -1.26 -5.05 121.20 122.94 3k5t s ILE 143 Ca 0.70 1.92 0.02 0.00 -1.41 0.00 0.00 60.65 61.89 3k5t s ILE 143 Cb -0.25 -4.26 0.02 0.00 0.13 0.00 0.00 42.46 38.10 3k5t s ILE 143 CO 0.46 0.12 0.72 -0.94 -1.91 0.00 0.00 174.94 173.40 3k5t s SER 144 N 1.01 5.45 0.13 4.50 1.04 -1.26 -4.97 113.70 119.61 3k5t s SER 144 Ca 0.48 0.01 -0.22 0.00 0.48 0.00 0.00 55.95 56.69 3k5t s SER 144 Cb -0.19 -1.01 -0.01 0.00 0.10 0.00 0.00 66.02 64.91 3k5t s SER 144 CO 0.22 -0.99 1.66 0.74 0.98 0.00 0.00 173.24 175.85 3k5t h THR 145 N 0.22 0.55 -0.26 2.02 2.02 -1.91 -1.67 112.91 113.88 3k5t h THR 145 Ca -0.43 0.00 0.05 0.00 0.77 0.00 0.00 66.41 66.80 3k5t h THR 145 Cb 1.28 0.55 -0.05 0.00 -1.74 0.00 0.00 68.15 68.19 3k5t h THR 145 CO 0.53 0.00 -0.07 0.00 0.37 0.00 0.00 175.52 176.35 3k5t h ALA 146 N 0.84 0.16 -0.59 6.16 0.00 -1.89 -0.85 119.26 123.09 3k5t h ALA 146 Ca 0.10 0.10 0.07 0.00 0.00 0.00 0.00 54.91 55.18 3k5t h ALA 146 Cb 0.36 0.21 -0.06 0.00 0.00 0.00 0.00 17.79 18.30 3k5t h ALA 146 CO -0.27 -0.47 0.26 1.49 0.00 0.00 0.00 179.25 180.26 3k5t h GLU 147 N -0.01 0.47 -0.92 0.00 4.81 -1.88 -0.04 114.58 117.01 3k5t h GLU 147 Ca 0.13 -0.03 0.07 0.00 -0.13 0.00 0.00 59.36 59.39 3k5t h GLU 147 Cb 0.20 -0.11 -0.07 0.00 0.63 0.00 0.00 28.75 29.41 3k5t h GLU 147 CO -0.27 0.31 0.58 1.88 -0.73 0.00 0.00 179.01 180.78 3k5t h TYR 148 N 0.49 1.08 0.84 0.92 0.99 -0.84 0.15 116.97 120.60 3k5t h TYR 148 Ca 0.28 0.03 -0.04 0.00 2.00 0.00 0.00 58.73 61.00 3k5t h TYR 148 Cb 0.27 -0.35 0.00 0.00 1.00 0.00 0.00 36.73 37.65 3k5t h TYR 148 CO -0.13 0.55 -0.46 0.00 -0.00 0.00 0.00 178.16 178.12 3k5t h ALA 149 N 1.43 -1.30 -0.95 3.88 0.00 0.37 0.16 119.26 122.85 3k5t h ALA 149 Ca 0.40 -0.26 0.23 0.00 0.00 0.00 0.00 54.91 55.29 3k5t h ALA 149 Cb 0.18 0.53 -0.12 0.00 0.00 0.00 0.00 17.79 18.39 3k5t h ALA 149 CO -0.18 -1.23 0.50 -0.07 0.00 0.00 0.00 179.25 178.27 3k5t h LEU 150 N -1.19 0.52 -0.80 0.00 3.38 -1.05 0.16 115.31 116.32 3k5t h LEU 150 Ca -0.11 0.14 -0.03 0.00 0.09 0.00 0.00 57.88 57.97 3k5t h LEU 150 Cb 0.93 0.08 -0.04 0.00 0.09 0.00 0.00 40.66 41.72 3k5t h LEU 150 CO 0.15 0.06 0.40 -0.07 0.09 0.00 0.00 178.44 179.07 3k5t h LEU 151 N 0.50 1.04 -1.63 1.67 3.38 -0.39 -0.92 115.31 118.96 3k5t h LEU 151 Ca 0.60 -0.13 -0.03 0.00 0.09 0.00 0.00 57.88 58.42 3k5t h LEU 151 Cb 1.13 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.61 3k5t h LEU 151 CO -0.50 0.87 -0.04 0.22 0.09 0.00 0.00 178.44 179.08 3k5t h TYR 152 N 1.13 0.18 0.10 1.13 3.20 0.10 -1.37 116.97 121.45 3k5t h TYR 152 Ca 0.28 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.13 3k5t h TYR 152 Cb 0.10 -0.06 0.00 0.00 1.54 0.00 0.00 36.73 38.31 3k5t h TYR 152 CO 0.01 0.23 -0.05 0.45 -1.64 0.00 0.00 178.16 177.16 3k5t h HIS 153 N 0.18 -0.13 -0.24 -3.82 3.86 -0.35 -2.35 115.15 112.29 3k5t h HIS 153 Ca 0.04 -0.00 0.06 0.00 -1.16 0.00 0.00 60.37 59.31 3k5t h HIS 153 Cb 0.20 0.04 -0.08 0.00 1.06 0.00 0.00 27.41 28.64 3k5t h HIS 153 CO 0.00 0.21 -0.36 1.15 0.86 0.00 0.00 177.93 179.79 3k5t h THR 154 N -0.47 0.21 0.00 2.45 2.02 -0.94 -1.66 112.91 114.53 3k5t h THR 154 Ca -0.01 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.15 3k5t h THR 154 Cb 0.39 0.21 -0.00 0.00 -1.74 0.00 0.00 68.15 67.01 3k5t h THR 154 CO 0.02 0.00 -0.06 0.25 0.37 0.00 0.00 175.52 176.11 3k5t h LEU 155 N -0.37 0.00 -0.06 2.58 5.85 -1.29 0.69 115.31 122.70 3k5t h LEU 155 Ca 0.12 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.79 3k5t h LEU 155 Cb 0.57 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.60 3k5t h LEU 155 CO -0.44 0.06 -0.15 1.56 -0.34 0.00 0.00 178.44 179.12 3k5t h GLN 156 N 0.00 0.21 0.92 1.25 4.20 -0.87 -2.65 115.11 118.18 3k5t h GLN 156 Ca -0.00 -0.14 -0.04 0.00 0.06 0.00 0.00 58.65 58.52 3k5t h GLN 156 Cb 0.10 0.02 0.00 0.00 0.30 0.00 0.00 27.48 27.91 3k5t h GLN 156 CO 0.01 0.74 -0.48 0.93 -0.67 0.00 0.00 178.83 179.36 3k5t h GLU 157 N -0.28 -1.24 0.00 1.46 4.39 -0.84 -3.11 114.58 114.95 3k5t h GLU 157 Ca -0.00 0.08 -0.02 0.00 0.34 0.00 0.00 59.36 59.76 3k5t h GLU 157 Cb 0.75 0.28 -0.00 0.00 -0.10 0.00 0.00 28.75 29.67 3k5t h GLU 157 CO 0.03 -0.83 -0.12 0.00 -1.16 0.00 0.00 179.01 176.94 3k5t h ALA 158 N -1.25 1.46 -0.11 3.43 0.00 -0.98 -1.20 119.26 120.61 3k5t h ALA 158 Ca -0.13 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.68 3k5t h ALA 158 Cb 1.00 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.78 3k5t h ALA 158 CO 0.18 0.15 0.00 0.25 0.00 0.00 0.00 179.25 179.83 3k5t n THR 159 N -3.90 0.12 -0.31 0.00 -2.24 -1.00 -4.42 114.28 102.53 3k5t n THR 159 Ca -0.02 -0.34 0.02 0.00 -2.27 0.00 0.00 64.05 61.43 3k5t n THR 159 Cb 0.21 0.55 0.07 0.00 -2.10 0.00 0.00 70.33 69.06 3k5t n THR 159 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3k5t n LYS 160 N 0.41 -0.14 0.28 -0.78 5.02 -0.46 0.98 118.16 123.47 3k5t n LYS 160 Ca 0.17 1.29 0.17 0.00 -2.02 0.00 0.00 58.31 57.93 3k5t n LYS 160 Cb 0.38 -1.93 0.95 0.00 -0.02 0.00 0.00 35.03 34.41 3k5t n LYS 160 CO 0.00 0.00 0.00 -1.35 -0.52 0.00 0.00 177.40 175.53 3k5t h PRO 161 N 0.00 0.00 -0.20 1.97 0.11 -1.82 -2.60 132.00 129.46 3k5t h PRO 161 Ca 0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.45 3k5t h PRO 161 Cb 0.55 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.66 3k5t h PRO 161 CO -0.84 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 178.23 3k5t n LEU 162 N -3.60 2.62 -0.17 2.35 4.77 0.27 -4.51 117.00 118.74 3k5t n LEU 162 Ca -0.01 -1.03 -0.06 0.00 -0.03 0.00 0.00 56.01 54.87 3k5t n LEU 162 Cb 0.18 -0.12 -0.00 0.00 -2.33 0.00 0.00 43.42 41.15 3k5t n LEU 162 CO 0.25 0.52 0.63 -0.74 -1.33 0.00 0.00 177.39 176.71 3k5t h HIS 163 N 3.66 -0.94 -0.00 -1.77 2.76 -1.36 0.33 115.15 117.82 3k5t h HIS 163 Ca 0.00 0.07 0.00 0.00 -2.20 0.00 0.00 60.37 58.24 3k5t h HIS 163 Cb 0.79 0.49 -0.00 0.00 1.55 0.00 0.00 27.41 30.24 3k5t h HIS 163 CO 0.12 -0.39 0.00 1.96 -1.30 0.00 0.00 177.93 178.33 3k5t h GLN 164 N -0.20 0.01 -0.56 5.26 7.50 -1.85 -1.67 115.11 123.60 3k5t h GLN 164 Ca 0.21 -0.00 0.11 0.00 0.50 0.00 0.00 58.65 59.46 3k5t h GLN 164 Cb 0.55 -0.00 -0.11 0.00 0.05 0.00 0.00 27.48 27.96 3k5t h GLN 164 CO -0.63 0.02 -0.25 0.35 -1.50 0.00 0.00 178.83 176.81 3k5t h PHE 165 N -0.01 -0.65 -0.06 2.96 3.57 -1.53 0.44 116.94 121.67 3k5t h PHE 165 Ca 0.00 0.06 0.04 0.00 3.53 0.00 0.00 57.97 61.60 3k5t h PHE 165 Cb 0.01 0.37 -0.04 0.00 2.79 0.00 0.00 35.95 39.08 3k5t h PHE 165 CO -0.08 -0.33 -0.20 0.74 -2.23 0.00 0.00 178.31 176.21 3k5t h PHE 166 N -0.11 -0.52 -0.63 0.41 0.04 0.13 0.86 116.94 117.12 3k5t h PHE 166 Ca 0.25 0.02 -0.03 0.00 2.80 0.00 0.00 57.97 61.01 3k5t h PHE 166 Cb 0.51 0.24 -0.03 0.00 2.20 0.00 0.00 35.95 38.87 3k5t h PHE 166 CO -0.56 -0.28 0.27 -0.07 -0.60 0.00 0.00 178.31 177.08 3k5t h LEU 167 N -0.29 0.86 -0.74 1.54 3.38 -0.79 0.72 115.31 119.99 3k5t h LEU 167 Ca 0.08 -0.16 -0.10 0.00 0.09 0.00 0.00 57.88 57.79 3k5t h LEU 167 Cb 0.39 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 3k5t h LEU 167 CO -0.22 0.78 -0.11 0.78 0.09 0.00 0.00 178.44 179.75 3k5t h ASN 168 N 0.88 0.84 0.11 -0.43 2.35 -0.61 -0.73 115.58 117.99 3k5t h ASN 168 Ca 0.21 -0.26 -0.26 0.00 -0.55 0.00 0.00 56.30 55.45 3k5t h ASN 168 Cb 0.17 -0.23 -0.00 0.00 0.05 0.00 0.00 38.32 38.31 3k5t h ASN 168 CO -0.02 0.97 -1.32 0.71 -1.65 0.00 0.00 177.43 176.12 3k5t h THR 169 N 0.76 1.09 0.00 2.81 1.35 -0.48 -3.43 112.91 115.01 3k5t h THR 169 Ca 0.12 -2.40 -0.01 0.00 -0.55 0.00 0.00 66.41 63.58 3k5t h THR 169 Cb 0.62 2.75 -0.00 0.00 -1.73 0.00 0.00 68.15 69.79 3k5t h THR 169 CO 0.04 0.69 -1.45 0.35 -0.25 0.00 0.00 175.52 174.90 3k5t n THR 170 N -3.98 0.03 -0.96 6.82 -2.24 0.25 -1.04 114.28 113.15 3k5t n THR 170 Ca -0.24 -0.23 0.00 0.00 -2.27 0.00 0.00 64.05 61.31 3k5t n THR 170 Cb 0.87 0.23 0.00 0.00 -2.10 0.00 0.00 70.33 69.33 3k5t n THR 170 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3k5t n GLY 171 N 1.97 0.34 3.48 3.38 0.00 -0.28 -4.88 105.19 109.20 3k5t n GLY 171 Ca -0.02 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.77 3k5t n GLY 171 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3k5t s PHE 172 N -1.78 2.03 0.31 1.61 0.40 -1.25 -4.86 117.98 114.45 3k5t s PHE 172 Ca 0.00 -0.93 -0.17 0.00 -0.60 0.00 0.00 56.93 55.23 3k5t s PHE 172 Cb 0.00 -1.35 0.03 0.00 0.51 0.00 0.00 43.02 42.21 3k5t s PHE 172 CO 0.00 0.06 0.69 -1.54 0.70 0.00 0.00 175.22 175.13 3k5t s SER 173 N -3.52 -0.07 -0.00 1.36 1.04 -0.73 -3.39 113.70 108.38 3k5t s SER 173 Ca 0.36 -0.89 0.21 0.00 0.48 0.00 0.00 55.95 56.11 3k5t s SER 173 Cb 0.09 0.74 -0.20 0.00 0.10 0.00 0.00 66.02 66.75 3k5t s SER 173 CO 0.16 -1.42 0.89 0.49 0.98 0.00 0.00 173.24 174.34 3k5t n PHE 174 N -0.48 0.01 -4.82 5.02 3.72 -1.26 -0.65 117.46 119.00 3k5t n PHE 174 Ca -0.05 0.00 -0.28 0.00 -0.05 0.00 0.00 57.45 57.07 3k5t n PHE 174 Cb 0.60 -0.07 -0.17 0.00 -0.94 0.00 0.00 39.48 38.90 3k5t n PHE 174 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 3k5t s GLN 175 N -3.05 2.32 0.00 -1.08 -1.52 -1.26 -4.82 119.66 110.25 3k5t s GLN 175 Ca 0.07 -0.62 0.00 0.00 -1.95 0.00 0.00 55.36 52.85 3k5t s GLN 175 Cb 0.16 -1.84 0.00 0.00 -0.22 0.00 0.00 33.01 31.11 3k5t s GLN 175 CO 0.86 0.08 0.00 -0.40 -0.25 0.00 0.00 175.29 175.58 3k5t n ASP 176 N 3.75 0.00 0.00 5.90 5.68 -1.26 -4.85 116.55 125.77 3k5t n ASP 176 Ca -0.21 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.08 3k5t n ASP 176 Cb 0.52 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.50 3k5t n ASP 176 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3k5t n HIS 178 N 0.00 0.00 0.07 0.00 -0.00 -1.26 0.47 115.22 114.50 3k5t n HIS 178 Ca 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 57.72 57.58 3k5t n HIS 178 Cb 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 29.99 29.94 3k5t n HIS 178 CO 0.00 0.00 0.00 0.38 -0.00 0.00 0.00 176.34 176.72 3k5t h ASP 179 N 0.00 0.56 -3.87 4.39 3.04 -2.01 -3.41 116.42 115.12 3k5t h ASP 179 Ca 0.00 -0.45 -0.63 0.00 -3.24 0.00 0.00 57.03 52.71 3k5t h ASP 179 Cb 0.00 -0.17 -0.41 0.00 -1.04 0.00 0.00 39.33 37.71 3k5t h ASP 179 CO 0.00 1.25 -0.68 -0.60 -2.04 0.00 0.00 179.24 177.18 3k5t s ARG 180 N -3.26 1.71 -0.18 4.15 6.06 0.18 -5.06 118.95 122.54 3k5t s ARG 180 Ca -0.06 -2.41 -0.10 0.00 -2.50 0.00 0.00 55.73 50.66 3k5t s ARG 180 Cb 0.09 -2.88 -0.05 0.00 0.06 0.00 0.00 34.95 32.17 3k5t s ARG 180 CO 0.87 -1.15 0.15 0.00 -2.50 0.00 0.00 175.30 172.67 3k5t s LEU 182 N 0.16 4.44 0.43 0.00 1.43 0.18 -0.69 118.68 124.63 3k5t s LEU 182 Ca 0.10 2.16 0.06 0.00 -1.03 0.00 0.00 54.13 55.42 3k5t s LEU 182 Cb -0.11 -3.60 -0.06 0.00 0.03 0.00 0.00 46.19 42.44 3k5t s LEU 182 CO -0.01 -0.36 0.04 0.00 0.23 0.00 0.00 176.35 176.26 3k5t s ALA 183 N 0.10 3.43 0.07 4.21 0.00 0.66 -4.77 121.76 125.46 3k5t s ALA 183 Ca 0.53 -1.91 0.01 0.00 0.00 0.00 0.00 51.96 50.60 3k5t s ALA 183 Cb -0.31 0.05 -0.04 0.00 0.00 0.00 0.00 23.12 22.82 3k5t s ALA 183 CO 0.35 -0.12 -0.06 -0.59 0.00 0.00 0.00 175.76 175.34 3k5t s PHE 184 N -2.73 0.74 -0.26 0.00 -0.71 -1.26 0.95 117.98 114.71 3k5t s PHE 184 Ca 0.31 -0.79 0.01 0.00 -1.04 0.00 0.00 56.93 55.42 3k5t s PHE 184 Cb 0.07 -0.45 0.07 0.00 -1.21 0.00 0.00 43.02 41.51 3k5t s PHE 184 CO 0.16 -0.16 -0.03 0.99 -1.34 0.00 0.00 175.22 174.84 3k5t s THR 185 N -2.86 1.67 0.28 -4.49 2.01 -0.65 -4.94 115.64 106.65 3k5t s THR 185 Ca 0.03 -1.48 -0.29 0.00 0.31 0.00 0.00 61.69 60.26 3k5t s THR 185 Cb 0.00 -1.99 -0.09 0.00 0.01 0.00 0.00 72.50 70.43 3k5t s THR 185 CO -0.04 -0.23 1.12 1.51 -0.69 0.00 0.00 174.62 176.30 3k5t s ASP 186 N 1.30 7.21 0.41 3.53 -4.77 -1.26 -1.26 116.67 121.83 3k5t s ASP 186 Ca -0.02 2.30 0.08 0.00 -3.30 0.00 0.00 52.55 51.61 3k5t s ASP 186 Cb -0.19 -2.63 -0.01 0.00 -1.09 0.00 0.00 42.92 39.01 3k5t s ASP 186 CO -0.08 -0.19 0.46 0.68 0.70 0.00 0.00 175.17 176.73 3k5t s VAL 187 N -1.07 2.90 0.03 2.11 -7.23 -0.60 -4.98 120.40 111.55 3k5t s VAL 187 Ca 0.45 -1.19 -0.11 0.00 -1.81 0.00 0.00 61.98 59.33 3k5t s VAL 187 Cb -0.33 -3.02 0.01 0.00 0.56 0.00 0.00 36.38 33.60 3k5t s VAL 187 CO 0.42 -0.01 0.23 0.00 -0.31 0.00 0.00 175.10 175.42 3k5t s ALA 188 N -2.40 -0.49 1.20 1.32 0.00 -1.26 -4.50 121.76 115.63 3k5t s ALA 188 Ca 0.51 -0.12 -0.20 0.00 0.00 0.00 0.00 51.96 52.14 3k5t s ALA 188 Cb -0.06 0.25 0.29 0.00 0.00 0.00 0.00 23.12 23.60 3k5t s ALA 188 CO 0.30 -0.35 1.16 -1.25 0.00 0.00 0.00 175.76 175.63 3k5t s PRO 189 N -2.30 -1.24 -0.66 0.00 0.04 -1.24 -0.04 135.00 129.56 3k5t s PRO 189 Ca -0.07 -0.28 0.06 0.00 0.04 0.00 0.00 61.00 60.75 3k5t s PRO 189 Cb -0.02 -1.61 0.22 0.00 0.04 0.00 0.00 34.50 33.13 3k5t s PRO 189 CO -0.02 -3.69 0.66 0.54 0.04 0.00 0.00 177.00 174.53 3k5t n ARG 190 N -4.70 2.26 0.00 4.56 1.74 -1.26 -4.81 116.66 114.45 3k5t n ARG 190 Ca 0.16 -4.59 0.00 0.00 -0.77 0.00 0.00 57.85 52.65 3k5t n ARG 190 Cb 0.60 -2.25 0.00 0.00 -1.02 0.00 0.00 32.46 29.79 3k5t n ARG 190 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3k5t n GLY 191 N 1.25 0.78 0.00 -0.13 0.00 -1.02 -1.52 105.19 104.55 3k5t n GLY 191 Ca 0.26 -1.97 0.00 0.00 0.00 0.00 0.00 46.02 44.32 3k5t n GLY 191 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3k5t n VAL 192 N 5.92 0.00 -3.88 1.61 0.24 -1.26 -5.04 118.33 115.91 3k5t n VAL 192 Ca 0.00 -0.46 -0.09 0.00 -2.04 0.00 0.00 64.34 61.75 3k5t n VAL 192 Cb 0.00 1.02 -0.05 0.00 -1.47 0.00 0.00 33.84 33.33 3k5t n VAL 192 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3k5t s ALA 193 N -0.71 -0.40 0.24 2.33 0.00 -1.26 -5.10 121.76 116.85 3k5t s ALA 193 Ca 0.00 -0.63 -0.31 0.00 0.00 0.00 0.00 51.96 51.02 3k5t s ALA 193 Cb 0.00 0.89 -0.11 0.00 0.00 0.00 0.00 23.12 23.90 3k5t s ALA 193 CO 0.00 -0.75 1.64 0.45 0.00 0.00 0.00 175.76 177.11 3k5t s SER 194 N -2.94 6.41 0.00 0.00 0.15 -1.26 -2.34 113.70 113.71 3k5t s SER 194 Ca 0.15 2.87 0.00 0.00 0.70 0.00 0.00 55.95 59.67 3k5t s SER 194 Cb 0.01 -2.62 0.00 0.00 -1.71 0.00 0.00 66.02 61.70 3k5t s SER 194 CO 0.01 -0.92 0.00 0.61 1.20 0.00 0.00 173.24 174.13 3k5t n GLY 195 N 3.11 0.51 3.91 9.45 0.00 -1.26 -5.02 105.19 115.89 3k5t n GLY 195 Ca 0.12 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.86 3k5t n GLY 195 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3k5t s GLN 196 N -0.88 3.62 -0.47 1.61 -0.21 -0.99 -4.85 119.66 117.50 3k5t s GLN 196 Ca 0.00 -0.04 0.06 0.00 0.02 0.00 0.00 55.36 55.40 3k5t s GLN 196 Cb 0.00 -2.68 0.22 0.00 1.00 0.00 0.00 33.01 31.55 3k5t s GLN 196 CO 0.00 0.25 0.71 -2.13 -2.12 0.00 0.00 175.29 172.00 3k5t n ARG 197 N -0.86 0.64 -3.77 2.91 0.63 -1.04 -4.76 116.66 110.41 3k5t n ARG 197 Ca -0.02 -2.29 -0.29 0.00 -0.92 0.00 0.00 57.85 54.33 3k5t n ARG 197 Cb 0.54 -1.44 -0.15 0.00 0.45 0.00 0.00 32.46 31.86 3k5t n ARG 197 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 3k5t s ARG 198 N 0.27 0.85 -0.18 -0.14 0.52 -0.58 -1.17 118.95 118.53 3k5t s ARG 198 Ca 0.32 -0.96 -0.09 0.00 -0.52 0.00 0.00 55.73 54.49 3k5t s ARG 198 Cb 0.14 -2.15 -0.05 0.00 0.52 0.00 0.00 34.95 33.42 3k5t s ARG 198 CO -0.17 -0.86 0.11 -1.12 0.02 0.00 0.00 175.30 173.29 3k5t s SER 199 N 1.61 6.06 -0.19 0.23 0.01 0.02 -2.42 113.70 119.02 3k5t s SER 199 Ca 0.05 0.23 -0.27 0.00 1.31 0.00 0.00 55.95 57.27 3k5t s SER 199 Cb -0.17 -2.04 -0.01 0.00 0.21 0.00 0.00 66.02 64.01 3k5t s SER 199 CO -0.18 0.22 0.91 0.26 0.41 0.00 0.00 173.24 174.86 3k5t s TRP 200 N 0.12 3.40 -0.17 2.43 0.52 -1.26 -0.91 118.94 123.07 3k5t s TRP 200 Ca 0.08 1.34 -0.05 0.00 0.02 0.00 0.00 56.10 57.50 3k5t s TRP 200 Cb -0.11 -3.11 -0.03 0.00 -1.15 0.00 0.00 33.47 29.06 3k5t s TRP 200 CO -0.00 -0.32 -0.01 -0.51 0.02 0.00 0.00 176.95 176.12 3k5t s LEU 201 N 2.51 3.36 -0.34 2.99 1.43 0.35 -1.56 118.68 127.42 3k5t s LEU 201 Ca 0.41 -0.10 -0.16 0.00 -1.03 0.00 0.00 54.13 53.25 3k5t s LEU 201 Cb -0.16 -1.82 -0.01 0.00 0.03 0.00 0.00 46.19 44.22 3k5t s LEU 201 CO 0.11 0.16 0.43 -0.63 0.23 0.00 0.00 176.35 176.65 3k5t s ILE 202 N 0.43 5.10 -0.05 -0.59 1.01 -0.39 -1.80 121.20 124.91 3k5t s ILE 202 Ca -0.02 0.24 -0.30 0.00 0.00 0.00 0.00 60.65 60.57 3k5t s ILE 202 Cb -0.14 -3.87 -0.02 0.00 0.01 0.00 0.00 42.46 38.44 3k5t s ILE 202 CO 0.02 -0.12 1.01 -0.63 0.00 0.00 0.00 174.94 175.23 3k5t s ILE 203 N 2.19 4.77 0.12 2.92 -1.09 -0.73 -1.64 121.20 127.75 3k5t s ILE 203 Ca 0.15 2.00 0.04 0.00 -2.23 0.00 0.00 60.65 60.61 3k5t s ILE 203 Cb -0.16 -4.29 -0.04 0.00 -1.58 0.00 0.00 42.46 36.39 3k5t s ILE 203 CO 0.12 0.08 -0.09 -1.10 -1.23 0.00 0.00 174.94 172.72 3k5t s GLN 204 N 1.52 0.95 -0.18 2.79 -0.21 0.27 -0.39 119.66 124.41 3k5t s GLN 204 Ca 0.51 -1.35 -0.29 0.00 0.02 0.00 0.00 55.36 54.25 3k5t s GLN 204 Cb -0.20 -0.51 -0.00 0.00 1.00 0.00 0.00 33.01 33.30 3k5t s GLN 204 CO 0.23 0.06 1.06 1.03 -2.12 0.00 0.00 175.29 175.55 3k5t s ARG 205 N -3.50 4.30 -1.00 2.91 0.52 -0.29 0.24 118.95 122.13 3k5t s ARG 205 Ca 0.13 1.42 -0.24 0.00 -0.52 0.00 0.00 55.73 56.52 3k5t s ARG 205 Cb 0.02 -3.62 -0.05 0.00 0.52 0.00 0.00 34.95 31.81 3k5t s ARG 205 CO -0.01 -0.55 1.91 -0.47 0.02 0.00 0.00 175.30 176.20 3k5t s TYR 206 N 2.88 1.91 0.40 -0.53 5.04 0.13 -4.64 117.35 122.54 3k5t s TYR 206 Ca 0.47 0.45 0.04 0.00 -2.44 0.00 0.00 57.07 55.58 3k5t s TYR 206 Cb -0.17 -4.08 -0.04 0.00 0.35 0.00 0.00 41.96 38.01 3k5t s TYR 206 CO 0.11 -1.60 0.07 0.14 -1.34 0.00 0.00 175.55 172.93 3k5t s VAL 207 N 9.95 1.09 -0.31 3.14 -7.23 -1.26 -4.64 120.40 121.14 3k5t s VAL 207 Ca 0.68 -2.00 -0.42 0.00 -1.81 0.00 0.00 61.98 58.42 3k5t s VAL 207 Cb -0.04 -2.56 -0.18 0.00 0.56 0.00 0.00 36.38 34.16 3k5t s VAL 207 CO 0.03 0.00 1.60 1.21 -0.31 0.00 0.00 175.10 177.63 3k5t n GLU 208 N -0.90 0.61 -3.09 4.82 2.13 -1.26 -1.14 120.64 121.81 3k5t n GLU 208 Ca -0.07 0.22 -0.13 0.00 0.66 0.00 0.00 57.16 57.84 3k5t n GLU 208 Cb 0.66 -1.82 0.07 0.00 0.27 0.00 0.00 31.44 30.62 3k5t n GLU 208 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3k5t n GLY 209 N 3.76 -0.25 0.27 8.31 0.00 -1.26 -4.54 105.19 111.47 3k5t n GLY 209 Ca 0.27 0.03 0.18 0.00 0.00 0.00 0.00 46.02 46.50 3k5t n GLY 209 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 3k5t h TYR 210 N -1.41 0.00 -0.78 1.61 -0.00 -1.39 -1.96 116.97 113.04 3k5t h TYR 210 Ca -0.47 0.00 0.15 0.00 0.00 0.00 0.00 58.73 58.42 3k5t h TYR 210 Cb 1.26 0.00 -0.05 0.00 0.00 0.00 0.00 36.73 37.94 3k5t h TYR 210 CO 0.33 0.00 0.52 0.74 -0.00 0.00 0.00 178.16 179.75 3k5t h PHE 211 N 0.00 0.52 -0.33 0.10 -1.00 -1.88 -1.30 116.94 113.05 3k5t h PHE 211 Ca 0.00 0.02 0.00 0.00 2.81 0.00 0.00 57.97 60.80 3k5t h PHE 211 Cb 0.18 -0.16 0.00 0.00 3.61 0.00 0.00 35.95 39.58 3k5t h PHE 211 CO 0.00 0.20 0.00 1.28 -1.61 0.00 0.00 178.31 178.18 3k5t n LEU 212 N -4.49 2.58 -3.09 1.54 4.77 -0.73 -4.51 117.00 113.07 3k5t n LEU 212 Ca 0.15 -1.30 -0.25 0.00 -0.03 0.00 0.00 56.01 54.58 3k5t n LEU 212 Cb 0.53 -0.40 -0.05 0.00 -2.33 0.00 0.00 43.42 41.17 3k5t n LEU 212 CO 0.32 0.46 0.02 1.41 -1.33 0.00 0.00 177.39 178.28 3k5t n HIS 213 N 0.45 2.81 -2.37 -1.77 8.25 -0.49 -4.90 115.22 117.19 3k5t n HIS 213 Ca 0.13 -3.95 -0.40 0.00 -0.26 0.00 0.00 57.72 53.23 3k5t n HIS 213 Cb 0.49 -0.48 -0.04 0.00 1.12 0.00 0.00 29.99 31.09 3k5t n HIS 213 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 3k5t s PRO 214 N -2.93 4.51 0.16 -0.41 0.04 -1.26 -1.14 135.00 133.96 3k5t s PRO 214 Ca 0.45 1.90 0.08 0.00 0.04 0.00 0.00 61.00 63.47 3k5t s PRO 214 Cb 0.27 -3.10 -0.09 0.00 0.04 0.00 0.00 34.50 31.62 3k5t s PRO 214 CO -0.10 0.06 1.35 1.79 0.04 0.00 0.00 177.00 180.14 3k5t h THR 215 N 2.99 1.59 0.00 1.26 1.35 -1.07 -3.45 112.91 115.59 3k5t h THR 215 Ca -0.47 -3.10 0.00 0.00 -0.55 0.00 0.00 66.41 62.28 3k5t h THR 215 Cb 1.22 2.70 0.00 0.00 -1.73 0.00 0.00 68.15 70.33 3k5t h THR 215 CO 0.66 0.87 0.00 0.61 -0.25 0.00 0.00 175.52 177.41 3k5t n GLY 216 N 1.16 0.80 3.81 5.82 0.00 -1.26 -4.98 105.19 110.54 3k5t n GLY 216 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 3k5t n GLY 216 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3k5t s LEU 217 N 0.00 4.46 0.00 0.99 2.96 -1.26 -2.10 118.68 123.72 3k5t s LEU 217 Ca 0.00 1.00 0.03 0.00 -0.22 0.00 0.00 54.13 54.93 3k5t s LEU 217 Cb 0.00 -2.66 -0.01 0.00 0.50 0.00 0.00 46.19 44.02 3k5t s LEU 217 CO 0.00 0.27 -0.08 -1.61 -1.32 0.00 0.00 176.35 173.60 3k5t s GLU 218 N -0.82 0.65 -0.04 1.98 2.02 0.79 -1.77 118.70 121.52 3k5t s GLU 218 Ca 0.25 -0.36 0.02 0.00 0.02 0.00 0.00 54.97 54.91 3k5t s GLU 218 Cb -0.17 -0.62 0.01 0.00 0.10 0.00 0.00 34.13 33.45 3k5t s GLU 218 CO 0.14 0.17 -0.10 -0.51 0.02 0.00 0.00 175.26 174.97 3k5t s LEU 219 N -0.36 1.71 -0.31 1.80 1.43 -0.74 -0.29 118.68 121.90 3k5t s LEU 219 Ca 0.02 -0.23 -0.15 0.00 -1.03 0.00 0.00 54.13 52.74 3k5t s LEU 219 Cb -0.04 -0.65 -0.02 0.00 0.03 0.00 0.00 46.19 45.51 3k5t s LEU 219 CO -0.00 0.05 0.39 -0.22 0.23 0.00 0.00 176.35 176.80 3k5t s LEU 220 N 0.38 4.25 -0.19 1.79 2.96 -0.68 -0.50 118.68 126.70 3k5t s LEU 220 Ca -0.07 0.02 -0.01 0.00 -0.22 0.00 0.00 54.13 53.84 3k5t s LEU 220 Cb -0.11 -2.41 0.00 0.00 0.50 0.00 0.00 46.19 44.17 3k5t s LEU 220 CO 0.01 -0.29 -0.12 -0.69 -1.32 0.00 0.00 176.35 173.94 3k5t s VAL 221 N 2.09 2.78 -0.59 1.68 1.01 -0.08 -0.70 120.40 126.59 3k5t s VAL 221 Ca 0.14 -0.70 -0.26 0.00 0.00 0.00 0.00 61.98 61.16 3k5t s VAL 221 Cb -0.16 -2.22 0.04 0.00 0.00 0.00 0.00 36.38 34.04 3k5t s VAL 221 CO 0.11 0.48 1.09 -0.62 0.00 0.00 0.00 175.10 176.16 3k5t s ASP 222 N 1.24 6.36 -0.47 3.32 -1.08 -0.89 -0.80 116.67 124.35 3k5t s ASP 222 Ca 0.03 -0.21 0.04 0.00 -0.52 0.00 0.00 52.55 51.89 3k5t s ASP 222 Cb -0.14 -2.50 0.44 0.00 -1.46 0.00 0.00 42.92 39.26 3k5t s ASP 222 CO -0.06 -1.41 1.46 0.00 0.52 0.00 0.00 175.17 175.68 3k5t n HIS 223 N 8.10 3.02 -0.01 -5.34 1.44 -0.32 -2.97 115.22 119.15 3k5t n HIS 223 Ca 0.04 -2.60 -0.18 0.00 -2.01 0.00 0.00 57.72 52.97 3k5t n HIS 223 Cb 0.48 -0.63 -0.08 0.00 0.12 0.00 0.00 29.99 29.88 3k5t n HIS 223 CO 0.00 0.00 0.00 0.78 -2.81 0.00 0.00 176.34 174.31 3k5t h GLY 224 N 2.30 0.81 -1.99 -1.39 0.00 -1.88 -3.47 103.07 97.45 3k5t h GLY 224 Ca 0.43 -1.18 -0.50 0.00 0.00 0.00 0.00 47.33 46.08 3k5t h GLY 224 CO 1.04 1.05 0.42 -0.45 0.00 0.00 0.00 176.54 178.60 3k5t s SER 225 N -7.06 5.62 0.07 0.19 0.15 -1.26 -4.94 113.70 106.47 3k5t s SER 225 Ca -0.11 2.12 0.28 0.00 0.70 0.00 0.00 55.95 58.94 3k5t s SER 225 Cb 0.08 -2.57 1.02 0.00 -1.71 0.00 0.00 66.02 62.83 3k5t s SER 225 CO 0.89 -1.28 1.82 0.35 1.20 0.00 0.00 173.24 176.22 3k5t n THR 226 N -1.54 0.19 -3.32 6.45 -2.24 -1.26 -4.43 114.28 108.13 3k5t n THR 226 Ca 0.11 -0.10 -0.42 0.00 -2.27 0.00 0.00 64.05 61.37 3k5t n THR 226 Cb 0.51 -0.45 -0.09 0.00 -2.10 0.00 0.00 70.33 68.20 3k5t n THR 226 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3k5t s ASP 227 N -3.51 6.21 0.50 3.42 -1.08 -1.26 -3.32 116.67 117.62 3k5t s ASP 227 Ca 0.12 -0.51 0.34 0.00 -0.52 0.00 0.00 52.55 51.98 3k5t s ASP 227 Cb 0.17 -2.23 1.78 0.00 -1.46 0.00 0.00 42.92 41.18 3k5t s ASP 227 CO 0.57 -0.53 2.03 0.00 0.52 0.00 0.00 175.17 177.76 3k5t h ALA 228 N 8.66 1.00 0.00 3.66 0.00 -1.99 -1.66 119.26 128.93 3k5t h ALA 228 Ca -0.27 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.62 3k5t h ALA 228 Cb 1.12 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.90 3k5t h ALA 228 CO 0.78 0.00 -0.10 0.78 0.00 0.00 0.00 179.25 180.71 3k5t h GLY 229 N 0.34 0.00 1.11 0.00 0.00 -1.94 -2.58 103.07 100.00 3k5t h GLY 229 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3k5t h GLY 229 CO 0.00 0.00 -0.40 1.42 0.00 0.00 0.00 176.54 177.56 3k5t n HIS 230 N -3.65 0.00 -2.25 5.60 8.25 -0.62 -4.93 115.22 117.62 3k5t n HIS 230 Ca -0.02 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 57.07 3k5t n HIS 230 Cb 0.21 -0.28 -0.01 0.00 1.12 0.00 0.00 29.99 31.03 3k5t n HIS 230 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 3k5t s TRP 231 N -2.96 2.92 -0.05 4.41 0.51 -0.97 -4.97 118.94 117.82 3k5t s TRP 231 Ca 0.13 1.53 -0.19 0.00 -2.12 0.00 0.00 56.10 55.45 3k5t s TRP 231 Cb 0.18 -3.40 0.04 0.00 -0.81 0.00 0.00 33.47 29.47 3k5t s TRP 231 CO 0.66 -1.50 0.44 0.00 -0.51 0.00 0.00 176.95 176.03 3k5t s ALA 232 N -1.49 -1.11 -0.58 0.98 0.00 -1.16 -5.01 121.76 113.39 3k5t s ALA 232 Ca 0.61 0.78 -0.28 0.00 0.00 0.00 0.00 51.96 53.07 3k5t s ALA 232 Cb -0.30 -0.11 0.02 0.00 0.00 0.00 0.00 23.12 22.73 3k5t s ALA 232 CO 0.37 -0.28 1.32 0.08 0.00 0.00 0.00 175.76 177.24 3k5t s VAL 233 N -0.98 3.87 -1.05 0.00 1.01 -1.26 -2.10 120.40 119.89 3k5t s VAL 233 Ca -0.10 0.75 0.26 0.00 0.00 0.00 0.00 61.98 62.89 3k5t s VAL 233 Cb -0.03 -4.59 0.08 0.00 0.00 0.00 0.00 36.38 31.84 3k5t s VAL 233 CO 0.05 -1.29 1.56 -1.84 0.00 0.00 0.00 175.10 173.58 3k5t n GLU 234 N 8.62 0.05 -3.57 2.72 0.28 0.13 -4.90 120.64 123.98 3k5t n GLU 234 Ca 0.10 -0.02 -0.13 0.00 -0.16 0.00 0.00 57.16 56.94 3k5t n GLU 234 Cb 0.49 -1.50 -0.06 0.00 1.43 0.00 0.00 31.44 31.80 3k5t n GLU 234 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 177.13 175.83 3k5t s GLN 235 N -2.97 0.77 0.02 3.44 2.00 -1.24 -4.84 119.66 116.85 3k5t s GLN 235 Ca 0.13 0.28 0.07 0.00 -2.00 0.00 0.00 55.36 53.83 3k5t s GLN 235 Cb 0.18 0.37 -0.02 0.00 0.80 0.00 0.00 33.01 34.33 3k5t s GLN 235 CO 0.65 -0.22 -0.20 0.08 -0.50 0.00 0.00 175.29 175.10 3k5t s VAL 236 N -0.92 1.56 -0.05 1.34 1.01 -1.25 -1.68 120.40 120.40 3k5t s VAL 236 Ca -0.05 -1.03 0.01 0.00 0.00 0.00 0.00 61.98 60.91 3k5t s VAL 236 Cb -0.01 -1.34 0.02 0.00 0.00 0.00 0.00 36.38 35.05 3k5t s VAL 236 CO 0.04 0.28 -0.06 0.86 0.00 0.00 0.00 175.10 176.22 3k5t s TRP 237 N -0.66 0.91 -0.04 5.22 -0.00 0.60 -1.62 118.94 123.34 3k5t s TRP 237 Ca 0.07 -0.29 0.01 0.00 -0.00 0.00 0.00 56.10 55.89 3k5t s TRP 237 Cb -0.08 -0.78 0.02 0.00 -0.00 0.00 0.00 33.47 32.63 3k5t s TRP 237 CO 0.01 -0.24 -0.03 -0.47 -0.00 0.00 0.00 176.95 176.22 3k5t s TYR 238 N 1.01 0.55 -1.34 5.86 5.04 0.35 -0.15 117.35 128.67 3k5t s TYR 238 Ca -0.09 -0.11 -0.04 0.00 -2.44 0.00 0.00 57.07 54.38 3k5t s TYR 238 Cb -0.14 -0.54 0.04 0.00 0.35 0.00 0.00 41.96 41.67 3k5t s TYR 238 CO -0.00 -0.15 0.10 -1.71 -1.34 0.00 0.00 175.55 172.44 3k5t n ASN 239 N 4.03 0.35 0.00 4.32 5.15 -0.89 -0.10 115.26 128.11 3k5t n ASN 239 Ca -0.26 -1.06 0.00 0.00 -0.60 0.00 0.00 54.58 52.66 3k5t n ASN 239 Cb 0.51 -1.32 0.00 0.00 -0.53 0.00 0.00 39.78 38.43 3k5t n ASN 239 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3k5t n GLY 240 N -2.06 0.68 2.96 8.20 0.00 -1.26 -5.07 105.19 108.64 3k5t n GLY 240 Ca -0.20 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.70 3k5t n GLY 240 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3k5t s LYS 241 N -0.86 0.12 0.20 1.61 0.00 0.85 -5.14 119.74 116.52 3k5t s LYS 241 Ca 0.00 0.02 -0.17 0.00 0.00 0.00 0.00 55.97 55.82 3k5t s LYS 241 Cb 0.00 0.06 -0.08 0.00 0.00 0.00 0.00 37.83 37.81 3k5t s LYS 241 CO 0.00 -0.02 0.65 -0.06 0.00 0.00 0.00 175.35 175.92 3k5t s PHE 242 N -0.15 3.60 0.00 1.78 0.08 -1.26 -0.49 117.98 121.54 3k5t s PHE 242 Ca -0.02 1.23 0.00 0.00 0.12 0.00 0.00 56.93 58.26 3k5t s PHE 242 Cb -0.02 -2.50 0.00 0.00 -0.57 0.00 0.00 43.02 39.93 3k5t s PHE 242 CO 0.00 0.35 0.36 0.66 -0.10 0.00 0.00 175.22 176.49 3k5t n TYR 243 N 0.64 0.00 0.00 0.36 4.02 -0.64 -4.97 117.16 116.57 3k5t n TYR 243 Ca -0.03 -0.04 0.00 0.00 -0.01 0.00 0.00 57.90 57.82 3k5t n TYR 243 Cb 0.52 -0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.83 3k5t n TYR 243 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3k5t n GLY 244 N -0.04 1.81 3.21 2.72 0.00 -1.26 -4.42 105.19 107.21 3k5t n GLY 244 Ca 0.00 -0.02 -0.12 0.00 0.00 0.00 0.00 46.02 45.88 3k5t n GLY 244 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3k5t s SER 245 N 0.00 0.50 0.06 1.61 1.04 -1.26 -3.59 113.70 112.06 3k5t s SER 245 Ca 0.00 -1.30 -0.19 0.00 0.48 0.00 0.00 55.95 54.94 3k5t s SER 245 Cb 0.00 0.28 -0.12 0.00 0.10 0.00 0.00 66.02 66.29 3k5t s SER 245 CO 0.00 -0.75 1.42 -0.65 0.98 0.00 0.00 173.24 174.24 3k5t h PRO 246 N 2.68 0.40 -1.00 4.02 0.11 -1.86 -2.78 132.00 133.56 3k5t h PRO 246 Ca -0.36 -0.17 0.20 0.00 0.11 0.00 0.00 66.00 65.77 3k5t h PRO 246 Cb 1.23 -0.01 -0.11 0.00 0.11 0.00 0.00 31.00 32.22 3k5t h PRO 246 CO 0.58 0.70 0.61 0.93 -0.21 0.00 0.00 178.00 180.60 3k5t h GLU 247 N 0.10 0.70 -0.20 1.05 3.07 -1.93 0.14 114.58 117.51 3k5t h GLU 247 Ca 0.04 -0.04 -0.07 0.00 -0.50 0.00 0.00 59.36 58.79 3k5t h GLU 247 Cb 0.57 -0.16 -0.00 0.00 -0.84 0.00 0.00 28.75 28.32 3k5t h GLU 247 CO 0.03 0.46 -0.16 1.49 -1.40 0.00 0.00 179.01 179.43 3k5t h GLU 248 N 0.72 0.45 -0.92 2.33 4.81 -1.83 0.33 114.58 120.48 3k5t h GLU 248 Ca 0.59 -0.22 0.00 0.00 -0.13 0.00 0.00 59.36 59.59 3k5t h GLU 248 Cb 0.97 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 30.31 3k5t h GLU 248 CO -0.38 0.78 0.58 1.25 -0.73 0.00 0.00 179.01 180.51 3k5t h LEU 249 N 0.13 1.08 -0.07 1.64 5.85 -1.17 -0.60 115.31 122.17 3k5t h LEU 249 Ca 0.04 -0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.70 3k5t h LEU 249 Cb 0.68 -0.27 -0.00 0.00 0.37 0.00 0.00 40.66 41.44 3k5t h LEU 249 CO 0.04 0.81 0.02 0.00 -0.34 0.00 0.00 178.44 178.97 3k5t h ALA 250 N 1.38 0.09 -0.31 1.25 0.00 -0.35 0.20 119.26 121.52 3k5t h ALA 250 Ca 0.33 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 3k5t h ALA 250 Cb -0.10 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 3k5t h ALA 250 CO -0.07 -0.29 0.20 0.07 0.00 0.00 0.00 179.25 179.16 3k5t h ARG 251 N -0.08 0.42 -0.08 0.00 -0.00 -0.26 0.10 114.38 114.48 3k5t h ARG 251 Ca 0.02 -0.03 -0.09 0.00 -0.00 0.00 0.00 59.98 59.87 3k5t h ARG 251 Cb 0.22 -0.09 -0.01 0.00 -0.00 0.00 0.00 29.97 30.09 3k5t h ARG 251 CO -0.00 0.31 -0.38 0.87 -0.00 0.00 0.00 179.97 180.77 3k5t h LYS 252 N 0.41 0.17 0.28 0.08 1.57 -0.99 0.11 116.57 118.20 3k5t h LYS 252 Ca 0.11 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.81 3k5t h LYS 252 Cb -0.01 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.30 3k5t h LYS 252 CO -0.02 0.53 -0.14 -0.92 -0.57 0.00 0.00 179.45 178.33 3k5t h TYR 253 N 0.15 -0.35 -1.03 -1.35 3.20 -0.42 0.57 116.97 117.73 3k5t h TYR 253 Ca 0.02 -0.01 0.29 0.00 3.14 0.00 0.00 58.73 62.16 3k5t h TYR 253 Cb 0.74 0.12 -0.06 0.00 1.54 0.00 0.00 36.73 39.07 3k5t h TYR 253 CO 0.01 0.00 0.72 0.00 -1.64 0.00 0.00 178.16 177.25 3k5t h ALA 254 N -0.47 2.75 -0.92 1.82 0.00 -0.61 0.25 119.26 122.09 3k5t h ALA 254 Ca -0.04 -0.01 -0.51 0.00 0.00 0.00 0.00 54.91 54.36 3k5t h ALA 254 Cb 0.51 0.06 -0.28 0.00 0.00 0.00 0.00 17.79 18.08 3k5t h ALA 254 CO 0.06 -1.08 0.64 -0.25 0.00 0.00 0.00 179.25 178.63 3k5t n ASP 255 N -4.34 4.45 -1.41 0.00 9.92 0.01 -4.92 116.55 120.25 3k5t n ASP 255 Ca 0.23 -3.51 -0.17 0.00 -0.53 0.00 0.00 54.79 50.80 3k5t n ASP 255 Cb 1.02 -0.85 -0.07 0.00 -0.64 0.00 0.00 41.12 40.58 3k5t n ASP 255 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3k5t n GLY 256 N -0.95 1.65 0.22 0.44 0.00 0.86 -4.84 105.19 102.56 3k5t n GLY 256 Ca 0.55 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.68 3k5t n GLY 256 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3k5t n GLU 257 N -1.97 0.55 -3.65 1.61 1.02 0.20 -4.83 120.64 113.57 3k5t n GLU 257 Ca -0.17 -0.43 -0.39 0.00 -0.02 0.00 0.00 57.16 56.14 3k5t n GLU 257 Cb 0.61 -1.49 -0.12 0.00 -0.02 0.00 0.00 31.44 30.42 3k5t n GLU 257 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3k5t s VAL 258 N -2.75 4.26 -0.26 2.62 1.01 -1.10 -4.90 120.40 119.30 3k5t s VAL 258 Ca 0.14 -0.99 -0.29 0.00 0.00 0.00 0.00 61.98 60.84 3k5t s VAL 258 Cb 0.17 -3.41 -0.03 0.00 0.00 0.00 0.00 36.38 33.12 3k5t s VAL 258 CO 0.70 -0.23 1.81 -1.81 0.00 0.00 0.00 175.10 175.57 3k5t s ASP 259 N 1.52 6.02 0.35 3.32 1.11 -1.26 -4.91 116.67 122.82 3k5t s ASP 259 Ca 0.01 1.57 0.08 0.00 0.18 0.00 0.00 52.55 54.39 3k5t s ASP 259 Cb -0.19 -2.53 -0.04 0.00 1.07 0.00 0.00 42.92 41.23 3k5t s ASP 259 CO 0.05 -1.56 0.15 0.68 1.18 0.00 0.00 175.17 175.68 3k5t s VAL 260 N 6.40 2.92 -0.15 -1.27 -7.23 -1.26 -4.95 120.40 114.86 3k5t s VAL 260 Ca 0.81 -1.68 0.02 0.00 -1.81 0.00 0.00 61.98 59.31 3k5t s VAL 260 Cb -0.26 -2.98 0.01 0.00 0.56 0.00 0.00 36.38 33.71 3k5t s VAL 260 CO 0.33 -0.15 -0.20 -0.69 -0.31 0.00 0.00 175.10 174.08 3k5t s VAL 261 N -2.45 2.24 -0.18 1.32 1.01 -1.26 -5.11 120.40 115.97 3k5t s VAL 261 Ca 0.38 -0.91 -0.15 0.00 0.00 0.00 0.00 61.98 61.30 3k5t s VAL 261 Cb -0.02 -1.92 -0.04 0.00 0.00 0.00 0.00 36.38 34.40 3k5t s VAL 261 CO 0.23 0.54 0.36 -0.69 0.00 0.00 0.00 175.10 175.53 3k5t s VAL 262 N 0.89 5.24 0.55 2.92 1.01 -1.26 -4.79 120.40 124.96 3k5t s VAL 262 Ca -0.05 0.65 -0.06 0.00 0.00 0.00 0.00 61.98 62.52 3k5t s VAL 262 Cb -0.15 -3.69 -0.02 0.00 0.00 0.00 0.00 36.38 32.52 3k5t s VAL 262 CO -0.03 0.31 0.87 -0.76 0.00 0.00 0.00 175.10 175.49 3k5t s LEU 263 N 0.94 3.40 0.00 3.92 1.43 -0.21 -5.05 118.68 123.11 3k5t s LEU 263 Ca 0.18 0.92 0.00 0.00 -1.03 0.00 0.00 54.13 54.20 3k5t s LEU 263 Cb -0.14 -3.84 0.00 0.00 0.03 0.00 0.00 46.19 42.24 3k5t s LEU 263 CO 0.07 -0.83 0.00 -1.84 0.23 0.00 0.00 176.35 173.98 3k5t n GLU 264 N -2.47 1.87 -0.03 1.70 0.28 -1.26 -4.92 120.64 115.81 3k5t n GLU 264 Ca 0.03 0.00 -0.01 0.00 -0.16 0.00 0.00 57.16 57.02 3k5t n GLU 264 Cb 0.56 0.00 -0.01 0.00 1.43 0.00 0.00 31.44 33.42 3k5t n GLU 264 CO 0.00 0.00 0.00 -0.85 -0.16 0.00 0.00 177.13 176.12 3k5t n GLU 278 N 0.00 -0.03 -1.17 3.44 -0.00 -1.26 -4.99 120.64 116.63 3k5t n GLU 278 Ca 0.00 0.16 -0.37 0.00 -0.00 0.00 0.00 57.16 56.95 3k5t n GLU 278 Cb 0.00 -0.23 0.04 0.00 -0.00 0.00 0.00 31.44 31.25 3k5t n GLU 278 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.13 174.83 3k5t n PRO 279 N -3.32 0.09 -2.25 3.44 -0.02 -1.26 -4.96 135.00 126.73 3k5t n PRO 279 Ca 0.00 0.05 -0.30 0.00 -2.02 0.00 0.00 63.50 61.23 3k5t n PRO 279 Cb 0.02 -1.33 -0.00 0.00 -0.02 0.00 0.00 33.50 32.17 3k5t n PRO 279 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 3k5t s PRO 280 N -2.00 3.64 0.46 0.52 0.05 -1.26 -5.02 135.00 131.38 3k5t s PRO 280 Ca 0.55 0.58 -0.25 0.00 0.05 0.00 0.00 61.00 61.94 3k5t s PRO 280 Cb -0.35 -2.20 -0.08 0.00 0.05 0.00 0.00 34.50 31.92 3k5t s PRO 280 CO 0.68 -0.38 1.40 -1.17 0.05 0.00 0.00 177.00 177.58 3k5t s LEU 281 N -4.80 4.10 0.51 -3.56 2.96 -1.26 -4.89 118.68 111.73 3k5t s LEU 281 Ca 0.53 2.87 0.19 0.00 -0.22 0.00 0.00 54.13 57.49 3k5t s LEU 281 Cb -0.11 -3.97 1.28 0.00 0.50 0.00 0.00 46.19 43.90 3k5t s LEU 281 CO 0.47 -1.18 2.11 2.19 -1.32 0.00 0.00 176.35 178.61 3k5t h PHE 282 N 2.27 0.00 -0.00 5.38 -5.15 -1.95 -1.27 116.94 116.22 3k5t h PHE 282 Ca -0.51 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.26 3k5t h PHE 282 Cb 1.27 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.44 3k5t h PHE 282 CO 0.50 0.08 0.00 -1.13 -2.00 0.00 0.00 178.31 175.75 3k5t n SER 283 N -4.27 0.09 -4.96 -0.68 3.41 -1.26 -4.00 113.62 101.96 3k5t n SER 283 Ca -0.03 -1.15 -0.22 0.00 -0.26 0.00 0.00 58.87 57.21 3k5t n SER 283 Cb 0.16 -0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.09 3k5t n SER 283 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3k5t s SER 284 N -1.87 6.28 0.00 4.04 1.04 -0.48 -4.21 113.70 118.50 3k5t s SER 284 Ca 0.42 0.26 0.16 0.00 0.48 0.00 0.00 55.95 57.27 3k5t s SER 284 Cb 0.19 -1.92 0.59 0.00 0.10 0.00 0.00 66.02 64.98 3k5t s SER 284 CO 0.32 -0.21 1.43 1.41 0.98 0.00 0.00 173.24 177.17 3k5t n HIS 285 N -1.63 0.26 -2.47 5.02 8.25 -1.26 -4.65 115.22 118.73 3k5t n HIS 285 Ca -0.06 -0.13 -0.41 0.00 -0.26 0.00 0.00 57.72 56.86 3k5t n HIS 285 Cb 0.57 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.64 3k5t n HIS 285 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 3k5t s LYS 286 N -1.74 4.57 0.79 -0.41 1.02 -1.26 -4.99 119.74 117.71 3k5t s LYS 286 Ca 0.26 1.77 -0.14 0.00 0.02 0.00 0.00 55.97 57.89 3k5t s LYS 286 Cb 0.14 -3.26 0.07 0.00 -0.52 0.00 0.00 37.83 34.26 3k5t s LYS 286 CO 0.20 0.05 1.20 -2.14 -0.92 0.00 0.00 175.35 173.74 3k5t s PRO 287 N -0.45 1.80 0.12 -1.68 0.02 -1.26 -4.95 135.00 128.60 3k5t s PRO 287 Ca 0.50 1.72 -0.25 0.00 0.02 0.00 0.00 61.00 62.99 3k5t s PRO 287 Cb -0.30 -1.80 0.07 0.00 0.02 0.00 0.00 34.50 32.49 3k5t s PRO 287 CO 0.36 -2.09 0.85 -0.98 -0.33 0.00 0.00 177.00 174.82 3k5t s ARG 288 N -4.12 1.16 0.14 5.54 3.03 -1.26 -4.88 118.95 118.57 3k5t s ARG 288 Ca 0.73 -0.56 0.00 0.00 2.03 0.00 0.00 55.73 57.93 3k5t s ARG 288 Cb -0.28 0.45 0.00 0.00 -1.03 0.00 0.00 34.95 34.09 3k5t s ARG 288 CO 0.49 -0.52 0.00 0.41 -1.13 0.00 0.00 175.30 174.55 3k5t n GLY 289 N -0.38 -2.58 2.93 3.88 0.00 -1.26 -4.99 105.19 102.78 3k5t n GLY 289 Ca -0.08 -1.37 -0.21 0.00 0.00 0.00 0.00 46.02 44.36 3k5t n GLY 289 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3k5t s ASP 290 N -5.03 1.13 0.31 1.61 1.01 -1.26 -5.12 116.67 109.32 3k5t s ASP 290 Ca 0.00 -0.17 -0.29 0.00 0.71 0.00 0.00 52.55 52.80 3k5t s ASP 290 Cb 0.00 -0.53 -0.11 0.00 1.01 0.00 0.00 42.92 43.29 3k5t s ASP 290 CO 0.00 -0.03 1.48 -0.36 0.21 0.00 0.00 175.17 176.47 3k5t s PHE 291 N 0.80 2.82 -1.02 4.23 0.08 -1.26 -4.90 117.98 118.73 3k5t s PHE 291 Ca -0.12 1.05 0.14 0.00 0.12 0.00 0.00 56.93 58.12 3k5t s PHE 291 Cb -0.15 -3.93 0.59 0.00 -0.57 0.00 0.00 43.02 38.96 3k5t s PHE 291 CO 0.01 -2.91 1.43 -0.35 -0.10 0.00 0.00 175.22 173.30 3k5t n PRO 292 N 1.51 0.01 -3.79 0.24 -0.04 -1.26 -3.32 135.00 128.35 3k5t n PRO 292 Ca 0.04 0.26 -0.29 0.00 -0.04 0.00 0.00 63.50 63.47 3k5t n PRO 292 Cb 0.39 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.22 3k5t n PRO 292 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 3k5t s SER 293 N -2.98 3.88 0.71 3.54 0.15 -1.26 -5.13 113.70 112.61 3k5t s SER 293 Ca 0.07 -2.98 -0.11 0.00 0.70 0.00 0.00 55.95 53.63 3k5t s SER 293 Cb 0.09 -1.27 0.02 0.00 -1.71 0.00 0.00 66.02 63.15 3k5t s SER 293 CO 0.25 -0.22 1.07 -2.16 1.20 0.00 0.00 173.24 173.38 3k5t s PRO 294 N -0.17 2.78 -0.22 5.44 0.04 -1.21 -5.05 135.00 136.61 3k5t s PRO 294 Ca 0.20 0.95 -0.02 0.00 0.04 0.00 0.00 61.00 62.17 3k5t s PRO 294 Cb -0.19 -1.97 0.06 0.00 0.04 0.00 0.00 34.50 32.44 3k5t s PRO 294 CO -0.04 -1.21 0.02 0.42 0.04 0.00 0.00 177.00 176.23 3k5t s ILE 295 N -3.04 0.86 -1.58 0.56 1.01 -1.26 -5.00 121.20 112.75 3k5t s ILE 295 Ca 0.59 -0.86 0.13 0.00 0.00 0.00 0.00 60.65 60.51 3k5t s ILE 295 Cb -0.14 -1.33 0.14 0.00 0.01 0.00 0.00 42.46 41.13 3k5t s ILE 295 CO 0.55 -0.24 0.98 1.41 0.00 0.00 0.00 174.94 177.64 3k5t n HIS 296 N 4.91 0.08 -4.42 3.97 8.25 -1.26 -4.98 115.22 121.77 3k5t n HIS 296 Ca -0.09 -0.07 -0.23 0.00 -0.26 0.00 0.00 57.72 57.07 3k5t n HIS 296 Cb 0.46 -0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.46 3k5t n HIS 296 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 3k5t s VAL 297 N -1.09 2.22 0.48 1.59 -7.23 -1.26 -5.13 120.40 109.98 3k5t s VAL 297 Ca 0.17 -2.28 -0.22 0.00 -1.81 0.00 0.00 61.98 57.84 3k5t s VAL 297 Cb 0.12 -2.18 -0.07 0.00 0.56 0.00 0.00 36.38 34.81 3k5t s VAL 297 CO 0.17 -0.41 1.19 -0.94 -0.31 0.00 0.00 175.10 174.79 3k5t s SER 298 N -3.31 5.98 0.83 4.85 1.04 -1.26 -5.05 113.70 116.78 3k5t s SER 298 Ca 0.26 2.36 -0.11 0.00 0.48 0.00 0.00 55.95 58.93 3k5t s SER 298 Cb -0.04 -2.60 0.12 0.00 0.10 0.00 0.00 66.02 63.59 3k5t s SER 298 CO 0.12 -1.05 1.18 -0.83 0.98 0.00 0.00 173.24 173.63 3k5t s GLY 299 N -1.35 1.69 0.56 7.32 0.00 -1.26 -5.01 107.32 109.27 3k5t s GLY 299 Ca 0.66 -0.99 -0.19 0.00 0.00 0.00 0.00 44.72 44.20 3k5t s GLY 299 CO 0.36 -0.42 0.74 -1.05 0.00 0.00 0.00 173.10 172.73 3k5t n PRO 300 N -3.34 0.74 -4.21 2.90 -0.02 -1.26 -5.03 135.00 124.77 3k5t n PRO 300 Ca 0.11 0.28 -0.13 0.00 -2.02 0.00 0.00 63.50 61.74 3k5t n PRO 300 Cb 0.60 -1.91 -0.10 0.00 -0.02 0.00 0.00 33.50 32.08 3k5t n PRO 300 CO 0.00 0.00 0.00 -0.98 1.98 0.00 0.00 175.50 176.50 3k5t s ARG 301 N -2.32 0.96 0.13 -0.52 1.70 -1.26 -5.14 118.95 112.50 3k5t s ARG 301 Ca 0.71 -1.37 -0.30 0.00 -0.47 0.00 0.00 55.73 54.30 3k5t s ARG 301 Cb -0.45 -0.48 -0.06 0.00 -0.57 0.00 0.00 34.95 33.38 3k5t s ARG 301 CO 0.52 0.05 0.99 -0.51 -1.08 0.00 0.00 175.30 175.26 3k5t s LEU 302 N -3.02 4.50 -0.01 -1.89 1.43 -1.26 -5.07 118.68 113.36 3k5t s LEU 302 Ca 0.14 1.85 0.05 0.00 -1.03 0.00 0.00 54.13 55.14 3k5t s LEU 302 Cb 0.03 -3.59 -0.03 0.00 0.03 0.00 0.00 46.19 42.62 3k5t s LEU 302 CO -0.01 -0.09 -0.15 0.68 0.23 0.00 0.00 176.35 177.02 3k5t s VAL 303 N -0.08 3.04 -0.55 -1.59 -7.23 -1.26 -4.62 120.40 108.11 3k5t s VAL 303 Ca 0.47 -0.92 0.07 0.00 -1.81 0.00 0.00 61.98 59.79 3k5t s VAL 303 Cb -0.25 -2.25 0.28 0.00 0.56 0.00 0.00 36.38 34.73 3k5t s VAL 303 CO 0.31 0.46 0.74 1.67 -0.31 0.00 0.00 175.10 177.97 3k5t n GLN 304 N 1.89 2.15 0.28 4.82 7.27 -1.26 -4.94 117.38 127.59 3k5t n GLN 304 Ca -0.16 -4.29 0.12 0.00 0.07 0.00 0.00 57.00 52.75 3k5t n GLN 304 Cb 0.52 -1.98 0.81 0.00 2.41 0.00 0.00 30.24 32.00 3k5t n GLN 304 CO 0.00 0.00 0.00 -1.00 0.07 0.00 0.00 177.06 176.13 3k5t h PRO 305 N 3.76 0.00 -0.68 3.69 0.13 -1.89 -2.30 132.00 134.71 3k5t h PRO 305 Ca 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 3k5t h PRO 305 Cb 0.70 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.83 3k5t h PRO 305 CO 0.72 0.00 0.00 0.72 -0.23 0.00 0.00 178.00 179.21 3k5t n HIS 306 N -4.12 1.07 -1.28 1.56 8.25 -1.26 -4.96 115.22 114.48 3k5t n HIS 306 Ca -0.03 -0.49 0.03 0.00 -0.26 0.00 0.00 57.72 56.97 3k5t n HIS 306 Cb 0.09 -0.07 -0.01 0.00 1.12 0.00 0.00 29.99 31.13 3k5t n HIS 306 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3k5t n GLY 307 N 1.46 -2.12 3.76 -1.41 0.00 -0.87 -4.86 105.19 101.16 3k5t n GLY 307 Ca 0.24 -1.43 -0.41 0.00 0.00 0.00 0.00 46.02 44.41 3k5t n GLY 307 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3k5t s PRO 308 N -0.93 4.32 0.00 1.61 0.02 -1.26 -4.91 135.00 133.85 3k5t s PRO 308 Ca 0.00 2.24 0.21 0.00 0.02 0.00 0.00 61.00 63.47 3k5t s PRO 308 Cb 0.00 -3.10 0.61 0.00 0.02 0.00 0.00 34.50 32.04 3k5t s PRO 308 CO 0.00 -0.30 1.48 0.54 -0.33 0.00 0.00 177.00 178.39 3k5t n ARG 309 N 1.58 1.99 -4.24 5.54 1.74 -1.26 -4.84 116.66 117.16 3k5t n ARG 309 Ca 0.03 -1.49 -0.29 0.00 -0.77 0.00 0.00 57.85 55.33 3k5t n ARG 309 Cb 0.41 -1.43 -0.10 0.00 -1.02 0.00 0.00 32.46 30.33 3k5t n ARG 309 CO 0.00 0.00 0.00 -0.59 -1.52 0.00 0.00 177.63 175.52 3k5t s PHE 310 N -1.68 2.70 -0.28 -1.55 -0.12 -1.26 -4.62 117.98 111.16 3k5t s PHE 310 Ca 0.34 -0.18 -0.06 0.00 -0.05 0.00 0.00 56.93 56.97 3k5t s PHE 310 Cb 0.19 -1.40 0.00 0.00 -0.63 0.00 0.00 43.02 41.19 3k5t s PHE 310 CO 0.27 0.44 0.06 1.03 -0.05 0.00 0.00 175.22 176.97 3k5t s ARG 311 N -2.31 3.17 -0.19 1.99 0.52 -0.45 -4.93 118.95 116.75 3k5t s ARG 311 Ca 0.22 -0.80 -0.10 0.00 -0.52 0.00 0.00 55.73 54.53 3k5t s ARG 311 Cb -0.11 -3.30 -0.05 0.00 0.52 0.00 0.00 34.95 32.01 3k5t s ARG 311 CO 0.14 -0.39 0.13 -1.17 0.02 0.00 0.00 175.30 174.03 3k5t s LEU 312 N 1.50 4.22 -0.25 2.53 2.96 -1.26 -1.39 118.68 127.00 3k5t s LEU 312 Ca 0.03 0.26 -0.02 0.00 -0.22 0.00 0.00 54.13 54.18 3k5t s LEU 312 Cb -0.17 -2.08 0.12 0.00 0.50 0.00 0.00 46.19 44.56 3k5t s LEU 312 CO 0.02 0.21 0.28 -1.61 -1.32 0.00 0.00 176.35 173.93 3k5t s GLU 313 N 0.17 0.27 7.82 1.98 0.41 0.77 -5.01 118.70 125.11 3k5t s GLU 313 Ca 0.09 0.13 0.00 0.00 -0.41 0.00 0.00 54.97 54.78 3k5t s GLU 313 Cb -0.11 -0.85 0.00 0.00 -1.78 0.00 0.00 34.13 31.39 3k5t s GLU 313 CO -0.01 -0.80 0.00 0.41 -0.49 0.00 0.00 175.26 174.37 3k5t n GLY 314 N 5.32 3.51 1.96 -1.39 0.00 -1.26 -1.33 105.19 112.00 3k5t n GLY 314 Ca -0.04 -0.08 -0.13 0.00 0.00 0.00 0.00 46.02 45.77 3k5t n GLY 314 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3k5t n ASN 315 N 7.14 4.07 -4.23 1.61 6.94 -1.26 -4.93 115.26 124.60 3k5t n ASN 315 Ca 0.00 -3.45 -0.33 0.00 -0.02 0.00 0.00 54.58 50.79 3k5t n ASN 315 Cb 0.00 -0.76 -0.16 0.00 -2.36 0.00 0.00 39.78 36.49 3k5t n ASN 315 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3k5t s ALA 316 N -3.15 2.35 0.01 -2.53 0.00 -0.44 -1.99 121.76 116.01 3k5t s ALA 316 Ca 0.54 -1.04 0.08 0.00 0.00 0.00 0.00 51.96 51.55 3k5t s ALA 316 Cb 0.45 -1.05 -0.03 0.00 0.00 0.00 0.00 23.12 22.49 3k5t s ALA 316 CO 0.11 0.05 -0.25 0.08 0.00 0.00 0.00 175.76 175.75 3k5t s VAL 317 N 0.69 2.21 -0.01 0.00 1.01 -0.50 -0.16 120.40 123.64 3k5t s VAL 317 Ca -0.09 -1.22 0.06 0.00 0.00 0.00 0.00 61.98 60.73 3k5t s VAL 317 Cb -0.16 -1.83 -0.02 0.00 0.00 0.00 0.00 36.38 34.38 3k5t s VAL 317 CO 0.01 0.46 -0.20 -0.76 0.00 0.00 0.00 175.10 174.62 3k5t s LEU 318 N -0.97 2.05 -0.30 3.92 1.43 -0.48 -2.13 118.68 122.20 3k5t s LEU 318 Ca 0.11 -0.37 0.04 0.00 -1.03 0.00 0.00 54.13 52.88 3k5t s LEU 318 Cb -0.10 -1.02 0.17 0.00 0.03 0.00 0.00 46.19 45.28 3k5t s LEU 318 CO 0.01 0.24 0.48 -0.47 0.23 0.00 0.00 176.35 176.84 3k5t s TYR 319 N -0.50 -1.30 0.00 0.29 5.04 -0.62 -1.34 117.35 118.92 3k5t s TYR 319 Ca 0.08 0.51 0.00 0.00 -2.44 0.00 0.00 57.07 55.22 3k5t s TYR 319 Cb -0.08 0.01 0.00 0.00 0.35 0.00 0.00 41.96 42.25 3k5t s TYR 319 CO -0.01 -1.03 0.00 0.41 -1.34 0.00 0.00 175.55 173.58 3k5t n GLY 320 N 5.27 3.99 0.28 8.97 0.00 -1.26 -0.82 105.19 121.63 3k5t n GLY 320 Ca 0.03 0.19 0.18 0.00 0.00 0.00 0.00 46.02 46.43 3k5t n GLY 320 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3k5t h GLY 321 N 0.00 0.00 -3.25 -0.02 0.00 -1.93 -3.47 103.07 94.40 3k5t h GLY 321 Ca 0.00 0.00 -0.50 0.00 0.00 0.00 0.00 47.33 46.83 3k5t h GLY 321 CO 0.00 0.00 0.17 -0.98 0.00 0.00 0.00 176.54 175.73 3k5t s TRP 322 N -3.80 3.58 -0.11 5.60 0.52 0.00 -0.32 118.94 124.41 3k5t s TRP 322 Ca -0.01 1.45 -0.07 0.00 0.02 0.00 0.00 56.10 57.49 3k5t s TRP 322 Cb 0.10 -2.68 0.04 0.00 -1.15 0.00 0.00 33.47 29.78 3k5t s TRP 322 CO 0.46 0.23 0.27 0.45 0.02 0.00 0.00 176.95 178.38 3k5t s SER 323 N -1.80 -0.30 -0.03 2.95 0.15 -0.71 -1.59 113.70 112.37 3k5t s SER 323 Ca 0.48 0.57 -0.29 0.00 0.70 0.00 0.00 55.95 57.42 3k5t s SER 323 Cb -0.15 0.49 0.10 0.00 -1.71 0.00 0.00 66.02 64.75 3k5t s SER 323 CO 0.20 -0.15 0.87 0.72 1.20 0.00 0.00 173.24 176.08 3k5t s PHE 324 N 0.96 -0.40 0.45 3.44 -0.12 -0.90 0.37 117.98 121.78 3k5t s PHE 324 Ca -0.07 0.39 0.08 0.00 -0.05 0.00 0.00 56.93 57.28 3k5t s PHE 324 Cb -0.08 0.51 0.01 0.00 -0.63 0.00 0.00 43.02 42.83 3k5t s PHE 324 CO -0.07 -0.54 0.48 0.00 -0.05 0.00 0.00 175.22 175.05 3k5t s ALA 325 N -2.60 4.30 0.22 1.99 0.00 0.98 -1.41 121.76 125.23 3k5t s ALA 325 Ca 0.02 -1.80 -0.11 0.00 0.00 0.00 0.00 51.96 50.07 3k5t s ALA 325 Cb -0.01 -1.20 -0.01 0.00 0.00 0.00 0.00 23.12 21.91 3k5t s ALA 325 CO -0.06 -0.34 0.39 -0.59 0.00 0.00 0.00 175.76 175.17 3k5t s PHE 326 N -2.49 0.44 -0.04 0.00 -0.12 -0.84 -1.04 117.98 113.88 3k5t s PHE 326 Ca 0.50 -0.78 -0.29 0.00 -0.05 0.00 0.00 56.93 56.31 3k5t s PHE 326 Cb -0.05 0.05 0.09 0.00 -0.63 0.00 0.00 43.02 42.48 3k5t s PHE 326 CO 0.30 -0.88 0.78 -0.98 -0.05 0.00 0.00 175.22 174.40 3k5t s ARG 327 N -4.01 0.93 -0.45 1.99 1.70 -1.10 -4.67 118.95 113.33 3k5t s ARG 327 Ca 0.22 0.04 -0.09 0.00 -0.47 0.00 0.00 55.73 55.43 3k5t s ARG 327 Cb 0.01 0.44 0.10 0.00 -0.57 0.00 0.00 34.95 34.93 3k5t s ARG 327 CO 0.06 -0.33 0.31 -0.51 -1.08 0.00 0.00 175.30 173.76 3k5t s LEU 328 N -1.58 5.49 -0.07 -1.89 1.43 -1.26 -1.46 118.68 119.33 3k5t s LEU 328 Ca -0.04 -1.74 -0.30 0.00 -1.03 0.00 0.00 54.13 51.02 3k5t s LEU 328 Cb -0.00 -2.01 -0.03 0.00 0.03 0.00 0.00 46.19 44.17 3k5t s LEU 328 CO 0.02 -0.63 1.28 -0.60 0.23 0.00 0.00 176.35 176.64 3k5t s ARG 329 N 1.39 4.30 0.38 1.70 3.52 -0.61 -4.90 118.95 124.73 3k5t s ARG 329 Ca 0.05 1.76 0.07 0.00 -0.13 0.00 0.00 55.73 57.48 3k5t s ARG 329 Cb -0.25 -3.63 0.80 0.00 -1.56 0.00 0.00 34.95 30.31 3k5t s ARG 329 CO 0.01 -0.56 1.97 0.77 -0.81 0.00 0.00 175.30 176.68 3k5t h SER 330 N 7.83 0.60 0.12 -2.12 0.02 -1.85 -0.92 113.55 117.22 3k5t h SER 330 Ca -0.33 0.00 -0.18 0.00 -0.84 0.00 0.00 61.79 60.45 3k5t h SER 330 Cb 1.15 -0.13 0.02 0.00 0.14 0.00 0.00 62.40 63.59 3k5t h SER 330 CO 0.91 0.39 -0.76 0.77 -1.14 0.00 0.00 176.83 177.00 3k5t h SER 331 N 0.68 0.46 0.00 3.07 4.64 -1.90 -0.88 113.55 119.61 3k5t h SER 331 Ca 0.29 -0.94 -0.04 0.00 -0.47 0.00 0.00 61.79 60.63 3k5t h SER 331 Cb 0.27 -0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 62.21 3k5t h SER 331 CO -0.09 1.36 -1.48 -1.54 -0.87 0.00 0.00 176.83 174.20 3k5t n SER 332 N -4.15 2.78 0.00 4.97 3.41 -1.16 -3.58 113.62 115.89 3k5t n SER 332 Ca -0.13 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.48 3k5t n SER 332 Cb 0.79 1.28 0.00 0.00 -0.26 0.00 0.00 64.21 66.02 3k5t n SER 332 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3k5t n GLY 333 N 2.06 0.14 3.76 5.00 0.00 -0.36 -4.38 105.19 111.42 3k5t n GLY 333 Ca -0.05 -2.16 -0.39 0.00 0.00 0.00 0.00 46.02 43.42 3k5t n GLY 333 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3k5t s LEU 334 N 0.00 4.49 0.09 0.99 2.96 -1.26 -1.57 118.68 124.39 3k5t s LEU 334 Ca 0.00 2.06 0.03 0.00 -0.22 0.00 0.00 54.13 55.99 3k5t s LEU 334 Cb 0.00 -3.76 -0.04 0.00 0.50 0.00 0.00 46.19 42.89 3k5t s LEU 334 CO 0.00 -0.08 -0.09 -1.10 -1.32 0.00 0.00 176.35 173.77 3k5t s GLN 335 N -1.60 0.82 0.03 1.98 -0.21 -0.53 -2.40 119.66 117.74 3k5t s GLN 335 Ca 0.46 -1.19 0.08 0.00 0.02 0.00 0.00 55.36 54.73 3k5t s GLN 335 Cb -0.26 -0.40 -0.02 0.00 1.00 0.00 0.00 33.01 33.32 3k5t s GLN 335 CO 0.33 0.04 -0.22 0.14 -2.12 0.00 0.00 175.29 173.46 3k5t s VAL 336 N -2.76 1.80 0.02 1.09 -7.23 0.25 -2.71 120.40 110.84 3k5t s VAL 336 Ca 0.06 -1.20 0.01 0.00 -1.81 0.00 0.00 61.98 59.05 3k5t s VAL 336 Cb -0.01 -1.54 -0.01 0.00 0.56 0.00 0.00 36.38 35.38 3k5t s VAL 336 CO -0.01 0.30 -0.05 -0.76 -0.31 0.00 0.00 175.10 174.27 3k5t s LEU 337 N -1.07 2.15 -1.36 1.32 1.43 -0.21 -0.24 118.68 120.71 3k5t s LEU 337 Ca 0.09 -0.34 -0.06 0.00 -1.03 0.00 0.00 54.13 52.79 3k5t s LEU 337 Cb -0.09 -0.09 0.03 0.00 0.03 0.00 0.00 46.19 46.07 3k5t s LEU 337 CO 0.01 -0.13 0.95 -3.20 0.23 0.00 0.00 176.35 174.21 3k5t n ASN 338 N 2.12 -3.58 -4.65 2.29 5.15 0.08 -0.02 115.26 116.64 3k5t n ASN 338 Ca -0.19 -0.70 -0.43 0.00 -0.60 0.00 0.00 54.58 52.66 3k5t n ASN 338 Cb 0.56 -4.45 -0.02 0.00 -0.53 0.00 0.00 39.78 35.35 3k5t n ASN 338 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 3k5t s VAL 339 N -3.42 4.08 0.19 3.44 1.01 0.79 -4.30 120.40 122.18 3k5t s VAL 339 Ca 0.33 1.28 0.09 0.00 0.00 0.00 0.00 61.98 63.68 3k5t s VAL 339 Cb -0.15 -3.88 -0.04 0.00 0.00 0.00 0.00 36.38 32.30 3k5t s VAL 339 CO 0.78 -0.18 -0.08 -1.00 0.00 0.00 0.00 175.10 174.63 3k5t s HIS 340 N 3.86 2.65 -0.09 5.22 3.76 0.16 -0.68 115.29 130.17 3k5t s HIS 340 Ca 0.60 -0.22 -0.01 0.00 -0.15 0.00 0.00 55.06 55.28 3k5t s HIS 340 Cb -0.24 -1.28 0.03 0.00 1.11 0.00 0.00 32.58 32.21 3k5t s HIS 340 CO 0.20 0.53 -0.02 0.12 -0.85 0.00 0.00 174.74 174.72 3k5t s PHE 341 N -1.80 0.92 -0.93 1.40 5.36 -0.75 -1.74 117.98 120.45 3k5t s PHE 341 Ca 0.26 -0.37 -0.04 0.00 -0.96 0.00 0.00 56.93 55.82 3k5t s PHE 341 Cb -0.08 -0.94 0.00 0.00 -0.34 0.00 0.00 43.02 41.66 3k5t s PHE 341 CO 0.16 -0.40 0.47 0.41 -1.46 0.00 0.00 175.22 174.40 3k5t n GLY 342 N 5.08 -0.03 2.56 13.12 0.00 0.56 -3.22 105.19 123.26 3k5t n GLY 342 Ca -0.09 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.74 3k5t n GLY 342 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k5t n GLY 343 N -1.28 2.82 3.66 -0.02 0.00 -1.26 -5.02 105.19 104.09 3k5t n GLY 343 Ca -0.05 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.62 3k5t n GLY 343 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3k5t s GLU 344 N -0.31 3.56 0.48 1.61 2.02 -1.20 -5.02 118.70 119.84 3k5t s GLU 344 Ca 0.00 -0.37 -0.23 0.00 0.02 0.00 0.00 54.97 54.40 3k5t s GLU 344 Cb 0.00 -3.03 -0.07 0.00 0.10 0.00 0.00 34.13 31.13 3k5t s GLU 344 CO 0.00 0.46 1.21 0.50 0.02 0.00 0.00 175.26 177.45 3k5t s ARG 345 N -0.19 3.60 0.00 1.61 3.52 -1.26 -1.81 118.95 124.41 3k5t s ARG 345 Ca 0.07 1.87 0.00 0.00 -0.13 0.00 0.00 55.73 57.54 3k5t s ARG 345 Cb -0.12 -2.36 0.00 0.00 -1.56 0.00 0.00 34.95 30.91 3k5t s ARG 345 CO 0.02 -0.71 0.00 0.44 -0.81 0.00 0.00 175.30 174.24 3k5t n ILE 346 N -0.64 0.00 -3.69 4.11 -5.35 0.14 -1.42 119.36 112.52 3k5t n ILE 346 Ca 0.08 0.00 -0.17 0.00 -0.27 0.00 0.00 62.75 62.39 3k5t n ILE 346 Cb 0.47 -0.46 -0.16 0.00 -1.74 0.00 0.00 39.64 37.75 3k5t n ILE 346 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3k5t s ALA 347 N -1.78 0.00 0.23 -1.28 0.00 -1.06 -0.35 121.76 117.52 3k5t s ALA 347 Ca 0.00 0.40 -0.05 0.00 0.00 0.00 0.00 51.96 52.31 3k5t s ALA 347 Cb 0.00 -0.64 0.22 0.00 0.00 0.00 0.00 23.12 22.70 3k5t s ALA 347 CO 0.00 -0.44 1.75 -0.92 0.00 0.00 0.00 175.76 176.14 3k5t h TYR 348 N 8.16 1.05 -2.42 0.00 3.20 -1.52 0.22 116.97 125.67 3k5t h TYR 348 Ca -0.19 -0.13 -0.08 0.00 3.14 0.00 0.00 58.73 61.47 3k5t h TYR 348 Cb 1.12 -0.30 -0.23 0.00 1.54 0.00 0.00 36.73 38.86 3k5t h TYR 348 CO 0.46 0.88 -0.11 -2.00 -1.64 0.00 0.00 178.16 175.75 3k5t s GLU 349 N -5.21 0.59 -0.07 1.82 2.12 -1.19 -0.74 118.70 116.02 3k5t s GLU 349 Ca -0.11 0.81 0.01 0.00 0.36 0.00 0.00 54.97 56.04 3k5t s GLU 349 Cb 0.15 0.23 0.02 0.00 0.26 0.00 0.00 34.13 34.78 3k5t s GLU 349 CO 0.83 -0.10 -0.08 0.08 -0.54 0.00 0.00 175.26 175.45 3k5t s VAL 350 N 0.65 0.89 -0.07 3.70 1.01 0.67 -0.57 120.40 126.68 3k5t s VAL 350 Ca -0.03 -0.30 -0.17 0.00 0.00 0.00 0.00 61.98 61.48 3k5t s VAL 350 Cb -0.05 -0.87 0.04 0.00 0.00 0.00 0.00 36.38 35.50 3k5t s VAL 350 CO -0.04 0.31 0.41 -0.94 0.00 0.00 0.00 175.10 174.84 3k5t s SER 351 N 1.05 -0.34 0.06 3.32 1.04 -0.66 -0.59 113.70 117.58 3k5t s SER 351 Ca -0.08 0.43 -0.31 0.00 0.48 0.00 0.00 55.95 56.47 3k5t s SER 351 Cb -0.14 0.53 -0.06 0.00 0.10 0.00 0.00 66.02 66.44 3k5t s SER 351 CO -0.01 -0.38 1.31 -0.69 0.98 0.00 0.00 173.24 174.46 3k5t s VAL 352 N -0.82 3.72 -0.15 5.02 1.01 -1.01 -1.00 120.40 127.17 3k5t s VAL 352 Ca -0.09 1.20 0.01 0.00 0.00 0.00 0.00 61.98 63.10 3k5t s VAL 352 Cb -0.04 -3.77 -0.09 0.00 0.00 0.00 0.00 36.38 32.48 3k5t s VAL 352 CO 0.04 0.07 -0.13 0.00 0.00 0.00 0.00 175.10 175.07 3k5t n GLN 353 N 4.33 0.36 -3.54 2.72 1.13 0.11 -4.43 117.38 118.06 3k5t n GLN 353 Ca 0.11 0.09 -0.14 0.00 -1.94 0.00 0.00 57.00 55.11 3k5t n GLN 353 Cb 0.44 -1.28 -0.05 0.00 0.11 0.00 0.00 30.24 29.46 3k5t n GLN 353 CO 0.00 0.00 0.00 -2.00 -1.44 0.00 0.00 177.06 173.62 3k5t s GLU 354 N -2.29 0.89 -0.05 -1.09 2.56 -1.13 -4.52 118.70 113.07 3k5t s GLU 354 Ca -0.20 0.15 0.00 0.00 0.00 0.00 0.00 54.97 54.92 3k5t s GLU 354 Cb 0.05 0.42 0.02 0.00 2.00 0.00 0.00 34.13 36.62 3k5t s GLU 354 CO 0.33 -0.29 -0.02 0.00 -0.56 0.00 0.00 175.26 174.73 3k5t s ALA 355 N -1.40 0.55 0.06 6.30 0.00 -1.26 -0.86 121.76 125.16 3k5t s ALA 355 Ca -0.06 0.01 0.07 0.00 0.00 0.00 0.00 51.96 51.97 3k5t s ALA 355 Cb -0.00 -0.47 -0.03 0.00 0.00 0.00 0.00 23.12 22.62 3k5t s ALA 355 CO 0.05 -0.15 -0.19 0.08 0.00 0.00 0.00 175.76 175.55 3k5t s VAL 356 N 1.22 1.50 -0.20 0.00 1.01 0.40 -0.98 120.40 123.34 3k5t s VAL 356 Ca -0.07 -1.26 -0.03 0.00 0.00 0.00 0.00 61.98 60.63 3k5t s VAL 356 Cb -0.14 -1.34 0.06 0.00 0.00 0.00 0.00 36.38 34.97 3k5t s VAL 356 CO -0.02 0.05 0.05 0.00 0.00 0.00 0.00 175.10 175.17 3k5t s ALA 357 N -0.95 0.98 -0.25 5.51 0.00 0.15 -2.23 121.76 124.97 3k5t s ALA 357 Ca 0.05 -0.73 -0.05 0.00 0.00 0.00 0.00 51.96 51.22 3k5t s ALA 357 Cb -0.09 -1.20 -0.00 0.00 0.00 0.00 0.00 23.12 21.83 3k5t s ALA 357 CO 0.02 -1.22 0.02 -0.51 0.00 0.00 0.00 175.76 174.08 3k5t s LEU 358 N 1.87 3.36 0.27 0.00 1.43 -0.91 -0.13 118.68 124.57 3k5t s LEU 358 Ca 0.00 -0.51 0.09 0.00 -1.03 0.00 0.00 54.13 52.68 3k5t s LEU 358 Cb -0.17 -1.82 -0.04 0.00 0.03 0.00 0.00 46.19 44.19 3k5t s LEU 358 CO -0.10 -0.09 0.05 -0.31 0.23 0.00 0.00 176.35 176.13 3k5t s TYR 359 N 1.50 2.78 0.46 0.29 2.02 0.73 -1.41 117.35 123.71 3k5t s TYR 359 Ca 0.04 -0.22 0.07 0.00 -0.37 0.00 0.00 57.07 56.60 3k5t s TYR 359 Cb -0.16 -1.29 -0.00 0.00 -0.40 0.00 0.00 41.96 40.11 3k5t s TYR 359 CO -0.00 0.57 0.40 0.20 -1.57 0.00 0.00 175.55 175.14 3k5t s GLY 360 N -3.73 2.19 -0.08 0.71 0.00 -0.83 -4.61 107.32 100.97 3k5t s GLY 360 Ca 0.32 -1.78 -0.30 0.00 0.00 0.00 0.00 44.72 42.96 3k5t s GLY 360 CO 0.21 -1.77 0.99 -0.32 0.00 0.00 0.00 173.10 172.20 3k5t s GLY 361 N -4.18 -0.38 0.07 0.20 0.00 -1.22 -4.14 107.32 97.66 3k5t s GLY 361 Ca 0.45 1.37 -0.03 0.00 0.00 0.00 0.00 44.72 46.51 3k5t s GLY 361 CO 0.27 0.53 1.11 1.12 0.00 0.00 0.00 173.10 176.12 3k5t h HIS 362 N 2.11 0.43 -3.13 1.90 -0.00 -1.85 -3.37 115.15 111.23 3k5t h HIS 362 Ca -0.18 -0.31 -0.50 0.00 -0.00 0.00 0.00 60.37 59.38 3k5t h HIS 362 Cb 1.21 -0.02 0.01 0.00 -0.00 0.00 0.00 27.41 28.61 3k5t h HIS 362 CO 0.27 1.26 -0.11 0.95 -0.00 0.00 0.00 177.93 180.30 3k5t s THR 363 N -2.66 5.03 0.26 6.12 -4.23 -1.26 -4.91 115.64 113.99 3k5t s THR 363 Ca -0.04 -0.09 -0.03 0.00 -1.18 0.00 0.00 61.69 60.35 3k5t s THR 363 Cb 0.07 -3.80 0.26 0.00 1.34 0.00 0.00 72.50 70.37 3k5t s THR 363 CO 0.87 -0.50 1.87 1.55 -0.54 0.00 0.00 174.62 177.87 3k5t h PRO 364 N 1.10 1.08 -0.34 3.99 0.13 -1.99 -1.33 132.00 134.64 3k5t h PRO 364 Ca -0.48 -0.06 -0.04 0.00 -0.87 0.00 0.00 66.00 64.54 3k5t h PRO 364 Cb 1.20 -0.24 -0.01 0.00 0.13 0.00 0.00 31.00 32.08 3k5t h PRO 364 CO 0.64 0.71 0.05 0.00 -0.23 0.00 0.00 178.00 179.17 3k5t h ALA 365 N 1.46 0.46 -0.68 -0.56 0.00 -1.94 -1.58 119.26 116.42 3k5t h ALA 365 Ca 0.43 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 3k5t h ALA 365 Cb 0.21 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 3k5t h ALA 365 CO -0.19 0.17 0.41 0.78 0.00 0.00 0.00 179.25 180.42 3k5t h GLY 366 N 0.41 0.99 2.00 0.00 0.00 -1.72 -1.87 103.07 102.86 3k5t h GLY 366 Ca 0.10 -0.41 0.00 0.00 0.00 0.00 0.00 47.33 47.02 3k5t h GLY 366 CO 0.01 0.40 0.00 0.00 0.00 0.00 0.00 176.54 176.95 3k5t h MET 367 N 0.92 0.00 0.00 4.80 -0.00 -1.26 -3.16 114.93 116.24 3k5t h MET 367 Ca 0.24 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.94 3k5t h MET 367 Cb -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.58 3k5t h MET 367 CO -0.05 0.00 -0.20 0.94 -0.00 0.00 0.00 176.91 177.61 3k5t n GLN 368 N -2.47 0.11 -3.00 -0.10 -0.06 -0.60 -4.79 117.38 106.47 3k5t n GLN 368 Ca 0.03 0.07 -0.43 0.00 -2.00 0.00 0.00 57.00 54.67 3k5t n GLN 368 Cb 0.34 -1.60 -0.06 0.00 -4.06 0.00 0.00 30.24 24.87 3k5t n GLN 368 CO 0.00 0.00 0.00 0.99 -0.20 0.00 0.00 177.06 177.85 3k5t s THR 369 N -3.05 4.67 -0.39 1.69 2.01 -1.09 -3.77 115.64 115.71 3k5t s THR 369 Ca 0.11 0.16 0.02 0.00 0.31 0.00 0.00 61.69 62.29 3k5t s THR 369 Cb 0.16 -4.34 0.12 0.00 0.01 0.00 0.00 72.50 68.45 3k5t s THR 369 CO 0.61 -0.79 0.17 -0.54 -0.69 0.00 0.00 174.62 173.37 3k5t s LYS 370 N 3.21 1.22 -0.15 4.92 1.02 0.95 -0.19 119.74 130.71 3k5t s LYS 370 Ca 0.26 -1.77 -0.22 0.00 0.02 0.00 0.00 55.97 54.25 3k5t s LYS 370 Cb -0.14 -2.49 -0.03 0.00 -0.52 0.00 0.00 37.83 34.66 3k5t s LYS 370 CO 0.19 -1.07 0.67 0.71 -0.92 0.00 0.00 175.35 174.94 3k5t s TYR 371 N 0.76 3.45 -0.26 3.18 2.02 0.81 -3.60 117.35 123.70 3k5t s TYR 371 Ca 0.14 1.07 0.03 0.00 -0.37 0.00 0.00 57.07 57.94 3k5t s TYR 371 Cb -0.22 -2.82 0.06 0.00 -0.40 0.00 0.00 41.96 38.59 3k5t s TYR 371 CO -0.09 -0.09 -0.11 -0.51 -1.57 0.00 0.00 175.55 173.19 3k5t s LEU 372 N 1.55 3.46 0.51 -1.29 1.02 -1.26 0.32 118.68 122.98 3k5t s LEU 372 Ca 0.33 -1.40 0.31 0.00 0.02 0.00 0.00 54.13 53.39 3k5t s LEU 372 Cb -0.16 -1.55 1.16 0.00 0.02 0.00 0.00 46.19 45.65 3k5t s LEU 372 CO 0.13 -0.19 1.90 0.44 0.02 0.00 0.00 176.35 178.65 3k5t h ASP 373 N 7.77 0.00 0.49 2.29 3.32 -1.47 -2.52 116.42 126.31 3k5t h ASP 373 Ca -0.19 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 56.83 3k5t h ASP 373 Cb 1.04 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.59 3k5t h ASP 373 CO 0.46 0.00 -0.14 0.58 -1.72 0.00 0.00 179.24 178.42 3k5t h VAL 374 N 0.00 0.55 0.00 -1.35 2.07 -1.82 0.01 116.25 115.70 3k5t h VAL 374 Ca 0.00 -0.66 0.00 0.00 0.82 0.00 0.00 66.70 66.86 3k5t h VAL 374 Cb 0.59 1.44 0.00 0.00 -1.52 0.00 0.00 31.29 31.80 3k5t h VAL 374 CO 0.00 0.14 0.00 0.61 0.02 0.00 0.00 177.57 178.34 3k5t n GLY 375 N -0.49 -0.83 0.12 2.17 0.00 -0.95 -3.14 105.19 102.06 3k5t n GLY 375 Ca -0.01 -0.05 0.01 0.00 0.00 0.00 0.00 46.02 45.97 3k5t n GLY 375 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 3k5t n TRP 376 N -1.42 0.07 -1.72 1.61 7.02 -0.02 -4.54 117.44 118.43 3k5t n TRP 376 Ca 0.04 -0.35 -0.02 0.00 -1.02 0.00 0.00 57.50 56.16 3k5t n TRP 376 Cb 0.12 -0.03 0.01 0.00 -2.42 0.00 0.00 31.31 28.99 3k5t n TRP 376 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 3k5t n GLY 377 N -0.16 0.50 0.30 6.99 0.00 -1.15 -4.87 105.19 106.79 3k5t n GLY 377 Ca 0.02 -0.16 0.06 0.00 0.00 0.00 0.00 46.02 45.95 3k5t n GLY 377 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3k5t h LEU 378 N -0.11 0.31 0.00 0.99 5.85 -1.59 0.17 115.31 120.94 3k5t h LEU 378 Ca -0.07 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.65 3k5t h LEU 378 Cb 1.03 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.99 3k5t h LEU 378 CO 0.05 0.22 -0.40 0.61 -0.34 0.00 0.00 178.44 178.58 3k5t n GLY 379 N -1.50 -1.49 0.27 3.75 0.00 -0.44 -4.05 105.19 101.71 3k5t n GLY 379 Ca 0.02 -0.18 0.12 0.00 0.00 0.00 0.00 46.02 45.98 3k5t n GLY 379 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3k5t n SER 380 N -2.08 1.27 -2.37 1.61 7.64 0.02 -4.17 113.62 115.55 3k5t n SER 380 Ca 0.04 -1.02 -0.32 0.00 1.01 0.00 0.00 58.87 58.59 3k5t n SER 380 Cb 0.42 0.36 0.04 0.00 -1.01 0.00 0.00 64.21 64.03 3k5t n SER 380 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 3k5t n VAL 381 N -0.66 3.15 -2.75 0.44 0.24 -1.02 -4.87 118.33 112.87 3k5t n VAL 381 Ca 0.09 -3.82 -0.43 0.00 -2.04 0.00 0.00 64.34 58.14 3k5t n VAL 381 Cb 0.38 -1.18 0.00 0.00 -1.47 0.00 0.00 33.84 31.57 3k5t n VAL 381 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 3k5t n THR 382 N -0.73 4.35 -1.99 3.34 -2.24 -1.26 -1.95 114.28 113.80 3k5t n THR 382 Ca 0.53 -4.69 -0.30 0.00 -2.27 0.00 0.00 64.05 57.31 3k5t n THR 382 Cb 0.67 -2.42 0.01 0.00 -2.10 0.00 0.00 70.33 66.49 3k5t n THR 382 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 3k5t s HIS 383 N 0.83 3.60 -0.11 4.78 3.76 -1.26 -4.36 115.29 122.53 3k5t s HIS 383 Ca 0.41 1.20 -0.35 0.00 -0.15 0.00 0.00 55.06 56.16 3k5t s HIS 383 Cb 0.02 -2.67 -0.13 0.00 1.11 0.00 0.00 32.58 30.90 3k5t s HIS 383 CO 0.00 -0.65 1.82 -1.91 -0.85 0.00 0.00 174.74 173.15 3k5t n GLU 384 N -2.69 1.94 -2.25 1.40 2.13 -1.25 -4.70 120.64 115.22 3k5t n GLU 384 Ca 0.05 0.71 -0.41 0.00 0.66 0.00 0.00 57.16 58.18 3k5t n GLU 384 Cb 0.54 -2.51 -0.03 0.00 0.27 0.00 0.00 31.44 29.71 3k5t n GLU 384 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 3k5t s LEU 385 N 3.64 4.47 -0.38 4.31 1.43 -0.58 -5.01 118.68 126.57 3k5t s LEU 385 Ca 0.93 2.53 -0.16 0.00 -1.03 0.00 0.00 54.13 56.40 3k5t s LEU 385 Cb -0.78 -3.64 0.00 0.00 0.03 0.00 0.00 46.19 41.81 3k5t s LEU 385 CO 0.53 -0.39 0.37 0.00 0.23 0.00 0.00 176.35 177.09 3k5t s ALA 386 N -1.09 3.47 0.12 4.21 0.00 -1.26 -4.92 121.76 122.29 3k5t s ALA 386 Ca 0.48 -1.40 -0.34 0.00 0.00 0.00 0.00 51.96 50.70 3k5t s ALA 386 Cb -0.37 -2.89 -0.13 0.00 0.00 0.00 0.00 23.12 19.73 3k5t s ALA 386 CO 0.48 -1.28 1.66 -2.30 0.00 0.00 0.00 175.76 174.32 3k5t n PRO 387 N 5.40 2.26 0.00 0.00 -0.02 -1.26 -0.91 135.00 140.47 3k5t n PRO 387 Ca -0.09 0.82 0.00 0.00 -2.02 0.00 0.00 63.50 62.21 3k5t n PRO 387 Cb 0.48 -2.62 0.00 0.00 -0.02 0.00 0.00 33.50 31.35 3k5t n PRO 387 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3k5t n GLY 388 N 3.69 1.92 0.73 -1.23 0.00 0.95 -4.75 105.19 106.50 3k5t n GLY 388 Ca 0.18 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.20 3k5t n GLY 388 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3k5t n ILE 389 N -2.00 0.15 -0.04 -0.61 5.41 -0.24 -4.76 119.36 117.28 3k5t n ILE 389 Ca 0.00 0.16 -0.16 0.00 1.00 0.00 0.00 62.75 63.75 3k5t n ILE 389 Cb 0.00 -1.21 -0.07 0.00 -0.71 0.00 0.00 39.64 37.65 3k5t n ILE 389 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 176.55 176.99 3k5t h ASP 390 N -0.03 0.76 -4.34 4.38 3.32 -1.34 -3.45 116.42 115.71 3k5t h ASP 390 Ca 0.00 -0.60 -0.31 0.00 0.02 0.00 0.00 57.03 56.14 3k5t h ASP 390 Cb 0.03 -0.22 -0.17 0.00 0.22 0.00 0.00 39.33 39.19 3k5t h ASP 390 CO 0.00 1.23 -0.73 0.00 -1.72 0.00 0.00 179.24 178.02 3k5t n PRO 392 N 0.41 0.66 -0.19 0.00 -0.02 -1.26 -0.04 135.00 134.56 3k5t n PRO 392 Ca -0.15 0.26 0.17 0.00 -2.02 0.00 0.00 63.50 61.76 3k5t n PRO 392 Cb 0.58 -1.89 0.51 0.00 -0.02 0.00 0.00 33.50 32.68 3k5t n PRO 392 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3k5t h GLU 393 N 0.33 0.39 -0.03 -0.52 3.07 -1.85 0.15 114.58 116.13 3k5t h GLU 393 Ca -0.47 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.37 3k5t h GLU 393 Cb 1.39 -0.09 0.00 0.00 -0.84 0.00 0.00 28.75 29.21 3k5t h GLU 393 CO 0.49 0.26 0.00 0.25 -1.40 0.00 0.00 179.01 178.61 3k5t n THR 394 N -4.48 0.04 -2.13 1.13 -2.24 -1.26 -4.77 114.28 100.56 3k5t n THR 394 Ca 0.16 -0.05 -0.32 0.00 -2.27 0.00 0.00 64.05 61.57 3k5t n THR 394 Cb 0.59 -0.15 -0.00 0.00 -2.10 0.00 0.00 70.33 68.67 3k5t n THR 394 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3k5t s ALA 395 N -1.96 2.90 -0.41 6.98 0.00 0.04 -4.92 121.76 124.39 3k5t s ALA 395 Ca 0.23 0.24 -0.18 0.00 0.00 0.00 0.00 51.96 52.25 3k5t s ALA 395 Cb 0.11 -3.17 0.01 0.00 0.00 0.00 0.00 23.12 20.08 3k5t s ALA 395 CO 0.18 -0.61 0.50 0.99 0.00 0.00 0.00 175.76 176.83 3k5t s THR 396 N -2.63 5.01 -0.03 0.00 2.01 0.12 -4.93 115.64 115.18 3k5t s THR 396 Ca 0.61 -0.05 -0.16 0.00 0.31 0.00 0.00 61.69 62.40 3k5t s THR 396 Cb -0.13 -4.06 -0.05 0.00 0.01 0.00 0.00 72.50 68.27 3k5t s THR 396 CO 0.38 -0.41 0.42 -0.36 -0.69 0.00 0.00 174.62 173.96 3k5t s PHE 397 N 2.37 3.68 -0.03 4.92 0.40 -1.26 -0.91 117.98 127.14 3k5t s PHE 397 Ca 0.16 0.97 0.05 0.00 -0.60 0.00 0.00 56.93 57.51 3k5t s PHE 397 Cb -0.16 -2.36 -0.01 0.00 0.51 0.00 0.00 43.02 41.01 3k5t s PHE 397 CO 0.15 0.52 -0.19 -0.51 0.70 0.00 0.00 175.22 175.89 3k5t s LEU 398 N -0.65 1.98 0.57 -0.37 1.43 0.75 -4.90 118.68 117.50 3k5t s LEU 398 Ca 0.24 -0.38 0.05 0.00 -1.03 0.00 0.00 54.13 53.02 3k5t s LEU 398 Cb -0.16 -1.04 0.07 0.00 0.03 0.00 0.00 46.19 45.09 3k5t s LEU 398 CO 0.13 0.20 0.79 -1.81 0.23 0.00 0.00 176.35 175.89 3k5t s ASP 399 N -0.18 5.06 0.36 2.29 1.01 -1.26 -1.34 116.67 122.61 3k5t s ASP 399 Ca 0.01 -0.49 -0.17 0.00 0.71 0.00 0.00 52.55 52.61 3k5t s ASP 399 Cb -0.10 -0.19 0.06 0.00 1.01 0.00 0.00 42.92 43.70 3k5t s ASP 399 CO 0.01 -1.31 0.83 0.28 0.21 0.00 0.00 175.17 175.19 3k5t s THR 400 N -2.73 0.00 -0.05 -1.27 -1.32 -0.77 -4.82 115.64 104.67 3k5t s THR 400 Ca 0.61 -0.93 0.06 0.00 -1.21 0.00 0.00 61.69 60.21 3k5t s THR 400 Cb -0.07 -2.92 -0.01 0.00 -1.51 0.00 0.00 72.50 67.99 3k5t s THR 400 CO 0.39 0.00 -0.24 -0.36 -2.21 0.00 0.00 174.62 172.20 3k5t s PHE 401 N -2.23 2.28 -0.08 9.09 0.40 -1.26 -0.16 117.98 126.02 3k5t s PHE 401 Ca 0.17 -0.65 0.05 0.00 -0.60 0.00 0.00 56.93 55.90 3k5t s PHE 401 Cb -0.05 -1.49 -0.00 0.00 0.51 0.00 0.00 43.02 41.98 3k5t s PHE 401 CO 0.11 -0.19 -0.24 -1.01 0.70 0.00 0.00 175.22 174.59 3k5t s HIS 402 N -0.18 2.43 -0.74 0.36 3.76 -0.89 -4.90 115.29 115.13 3k5t s HIS 402 Ca -0.02 -0.86 -0.06 0.00 -0.15 0.00 0.00 55.06 53.98 3k5t s HIS 402 Cb -0.13 -1.61 0.19 0.00 1.11 0.00 0.00 32.58 32.14 3k5t s HIS 402 CO 0.03 -0.31 0.61 -0.47 -0.85 0.00 0.00 174.74 173.75 3k5t s TYR 403 N 0.10 3.61 -0.08 1.40 5.04 -1.26 -1.93 117.35 124.22 3k5t s TYR 403 Ca -0.11 -2.60 -0.01 0.00 -2.44 0.00 0.00 57.07 51.90 3k5t s TYR 403 Cb -0.16 -3.38 0.03 0.00 0.35 0.00 0.00 41.96 38.80 3k5t s TYR 403 CO 0.06 -0.86 -0.00 -0.47 -1.34 0.00 0.00 175.55 172.94 3k5t s TYR 404 N -0.31 0.74 -1.22 4.97 5.04 -1.26 -1.67 117.35 123.64 3k5t s TYR 404 Ca 0.20 -0.24 -0.26 0.00 -2.44 0.00 0.00 57.07 54.32 3k5t s TYR 404 Cb -0.15 -0.84 0.02 0.00 0.35 0.00 0.00 41.96 41.34 3k5t s TYR 404 CO -0.06 -0.36 0.67 -3.47 -1.34 0.00 0.00 175.55 170.99 3k5t n ASP 405 N 5.13 -4.08 -3.88 4.32 2.03 0.23 -4.95 116.55 115.36 3k5t n ASP 405 Ca -0.07 -1.18 -0.11 0.00 0.52 0.00 0.00 54.79 53.94 3k5t n ASP 405 Cb 0.50 -2.37 -0.11 0.00 -0.72 0.00 0.00 41.12 38.42 3k5t n ASP 405 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3k5t s ALA 406 N -3.58 -0.24 0.19 -1.67 0.00 -1.26 -4.89 121.76 110.31 3k5t s ALA 406 Ca 0.43 -0.07 0.10 0.00 0.00 0.00 0.00 51.96 52.42 3k5t s ALA 406 Cb -0.21 0.02 0.15 0.00 0.00 0.00 0.00 23.12 23.08 3k5t s ALA 406 CO 0.93 -0.16 1.49 -0.44 0.00 0.00 0.00 175.76 177.58 3k5t h ASP 407 N 4.84 0.00 -5.35 0.00 3.32 -1.92 -3.42 116.42 113.89 3k5t h ASP 407 Ca -0.29 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 56.61 3k5t h ASP 407 Cb 1.20 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 40.60 3k5t h ASP 407 CO 0.41 0.75 -0.57 -1.81 -1.72 0.00 0.00 179.24 176.30 3k5t s ASP 408 N -6.76 0.28 0.41 6.45 1.01 -1.26 -4.95 116.67 111.85 3k5t s ASP 408 Ca -0.00 -1.07 -0.27 0.00 0.71 0.00 0.00 52.55 51.92 3k5t s ASP 408 Cb 0.11 0.31 -0.10 0.00 1.01 0.00 0.00 42.92 44.26 3k5t s ASP 408 CO 0.78 -0.74 1.47 -2.84 0.21 0.00 0.00 175.17 174.05 3k5t s PRO 409 N -4.00 3.89 -0.13 8.23 0.02 -1.26 -4.85 135.00 136.91 3k5t s PRO 409 Ca 0.19 2.53 0.01 0.00 0.02 0.00 0.00 61.00 63.74 3k5t s PRO 409 Cb 0.07 -2.82 -0.01 0.00 0.02 0.00 0.00 34.50 31.76 3k5t s PRO 409 CO -0.01 -0.69 -0.16 0.08 -0.33 0.00 0.00 177.00 175.88 3k5t s VAL 410 N -1.15 2.72 -0.00 3.83 1.01 -0.81 -4.03 120.40 121.96 3k5t s VAL 410 Ca 0.57 -0.77 -0.30 0.00 0.00 0.00 0.00 61.98 61.48 3k5t s VAL 410 Cb -0.46 -2.12 -0.03 0.00 0.00 0.00 0.00 36.38 33.77 3k5t s VAL 410 CO 0.61 0.53 0.98 -2.28 0.00 0.00 0.00 175.10 174.93 3k5t s HIS 411 N 0.47 3.66 -0.34 5.22 2.46 0.17 -2.09 115.29 124.83 3k5t s HIS 411 Ca -0.11 1.69 0.02 0.00 0.47 0.00 0.00 55.06 57.13 3k5t s HIS 411 Cb -0.16 -3.12 0.09 0.00 -0.13 0.00 0.00 32.58 29.26 3k5t s HIS 411 CO 0.05 -0.01 0.06 0.71 -2.47 0.00 0.00 174.74 173.08 3k5t s TYR 412 N 1.03 3.63 0.15 3.88 1.51 0.78 -3.43 117.35 124.89 3k5t s TYR 412 Ca 0.52 -2.71 -0.30 0.00 -1.01 0.00 0.00 57.07 53.57 3k5t s TYR 412 Cb -0.21 -2.81 -0.07 0.00 -0.11 0.00 0.00 41.96 38.76 3k5t s TYR 412 CO 0.28 -0.94 0.95 -1.25 -1.11 0.00 0.00 175.55 173.48 3k5t s PRO 413 N 1.01 4.74 -1.43 -1.71 0.05 -1.26 -1.85 135.00 134.54 3k5t s PRO 413 Ca 0.07 1.45 -0.09 0.00 0.05 0.00 0.00 61.00 62.48 3k5t s PRO 413 Cb -0.20 -3.35 0.05 0.00 0.05 0.00 0.00 34.50 31.05 3k5t s PRO 413 CO -0.06 0.30 0.96 0.54 0.05 0.00 0.00 177.00 178.80 3k5t n ARG 414 N 2.41 -5.95 -0.04 4.56 1.74 -1.20 -3.83 116.66 114.36 3k5t n ARG 414 Ca 0.01 0.66 -0.06 0.00 -0.77 0.00 0.00 57.85 57.69 3k5t n ARG 414 Cb 0.49 -5.52 0.14 0.00 -1.02 0.00 0.00 32.46 26.54 3k5t n ARG 414 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3k5t h ALA 415 N 0.95 0.96 -2.49 7.54 0.00 -1.25 -1.54 119.26 123.43 3k5t h ALA 415 Ca -0.59 -0.37 -0.50 0.00 0.00 0.00 0.00 54.91 53.45 3k5t h ALA 415 Cb 1.37 -0.13 -0.16 0.00 0.00 0.00 0.00 17.79 18.87 3k5t h ALA 415 CO 0.62 0.60 -0.76 -0.51 0.00 0.00 0.00 179.25 179.21 3k5t s LEU 416 N -8.76 2.51 0.09 0.00 1.02 -0.71 -4.14 118.68 108.70 3k5t s LEU 416 Ca -0.08 -0.96 0.04 0.00 0.02 0.00 0.00 54.13 53.15 3k5t s LEU 416 Cb 0.13 -0.80 -0.03 0.00 0.02 0.00 0.00 46.19 45.51 3k5t s LEU 416 CO 0.82 -0.09 -0.11 0.00 0.02 0.00 0.00 176.35 176.99 3k5t s LEU 418 N -2.32 1.31 -0.06 0.00 2.96 -0.08 -1.14 118.68 119.35 3k5t s LEU 418 Ca 0.04 -0.16 -0.29 0.00 -0.22 0.00 0.00 54.13 53.50 3k5t s LEU 418 Cb -0.04 -0.53 0.07 0.00 0.50 0.00 0.00 46.19 46.18 3k5t s LEU 418 CO 0.01 -0.06 0.65 0.72 -1.32 0.00 0.00 176.35 176.35 3k5t s PHE 419 N 1.01 -0.62 -0.11 5.38 -0.12 -0.81 -0.70 117.98 122.01 3k5t s PHE 419 Ca -0.09 1.09 -0.10 0.00 -0.05 0.00 0.00 56.93 57.77 3k5t s PHE 419 Cb -0.14 0.38 -0.05 0.00 -0.63 0.00 0.00 43.02 42.58 3k5t s PHE 419 CO -0.00 -0.58 0.23 -2.00 -0.05 0.00 0.00 175.22 172.81 3k5t s GLU 420 N -1.13 3.78 0.02 1.99 2.12 -1.26 -0.47 118.70 123.75 3k5t s GLU 420 Ca -0.11 0.02 0.00 0.00 0.36 0.00 0.00 54.97 55.25 3k5t s GLU 420 Cb -0.01 -3.26 -0.02 0.00 0.26 0.00 0.00 34.13 31.10 3k5t s GLU 420 CO 0.09 0.61 -0.03 0.00 -0.54 0.00 0.00 175.26 175.39 3k5t s MET 421 N -0.62 0.29 0.29 4.30 0.23 -0.27 -4.96 119.30 118.56 3k5t s MET 421 Ca 0.16 -0.52 -0.29 0.00 -1.03 0.00 0.00 55.69 54.01 3k5t s MET 421 Cb -0.13 0.04 -0.10 0.00 -1.53 0.00 0.00 34.83 33.10 3k5t s MET 421 CO 0.05 -0.03 1.42 -2.14 -2.03 0.00 0.00 175.02 172.30 3k5t s PRO 422 N -1.22 4.26 0.15 3.16 0.02 -1.26 -1.32 135.00 138.79 3k5t s PRO 422 Ca -0.12 2.33 0.25 0.00 0.02 0.00 0.00 61.00 63.48 3k5t s PRO 422 Cb -0.08 -3.08 0.62 0.00 0.02 0.00 0.00 34.50 31.97 3k5t s PRO 422 CO -0.01 -0.39 1.57 0.25 -0.33 0.00 0.00 177.00 178.09 3k5t n THR 423 N 1.72 0.42 -0.88 0.99 -2.24 -0.80 -4.92 114.28 108.58 3k5t n THR 423 Ca 0.04 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.58 3k5t n THR 423 Cb 0.40 -0.34 0.00 0.00 -2.10 0.00 0.00 70.33 68.30 3k5t n THR 423 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3k5t n GLY 424 N 1.34 0.37 2.98 3.38 0.00 -1.26 -5.00 105.19 107.00 3k5t n GLY 424 Ca 0.05 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.83 3k5t n GLY 424 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3k5t s VAL 425 N -1.97 0.95 0.25 1.61 0.11 -1.26 -5.04 120.40 115.05 3k5t s VAL 425 Ca 0.00 -0.37 -0.30 0.00 -2.93 0.00 0.00 61.98 58.38 3k5t s VAL 425 Cb 0.00 -0.89 -0.10 0.00 -1.53 0.00 0.00 36.38 33.85 3k5t s VAL 425 CO 0.00 0.31 1.50 -2.16 -3.33 0.00 0.00 175.10 171.42 3k5t s PRO 426 N 0.74 4.22 0.29 1.54 0.04 -1.26 -3.26 135.00 137.30 3k5t s PRO 426 Ca -0.14 2.39 0.03 0.00 0.04 0.00 0.00 61.00 63.32 3k5t s PRO 426 Cb -0.15 -3.09 0.65 0.00 0.04 0.00 0.00 34.50 31.94 3k5t s PRO 426 CO 0.03 -0.50 1.77 1.25 0.04 0.00 0.00 177.00 179.59 3k5t h LEU 427 N 5.18 0.68 -7.54 -3.56 6.46 -0.98 -3.43 115.31 112.12 3k5t h LEU 427 Ca -0.46 0.09 -0.06 0.00 -0.12 0.00 0.00 57.88 57.33 3k5t h LEU 427 Cb 1.22 -0.02 -0.13 0.00 -0.73 0.00 0.00 40.66 40.99 3k5t h LEU 427 CO 0.80 0.26 -0.16 0.00 -0.62 0.00 0.00 178.44 178.72 3k5t s ARG 428 N -5.91 1.02 -0.07 1.25 1.70 -1.24 -5.00 118.95 110.69 3k5t s ARG 428 Ca -0.12 -0.80 -0.30 0.00 -0.47 0.00 0.00 55.73 54.05 3k5t s ARG 428 Cb 0.24 0.43 0.10 0.00 -0.57 0.00 0.00 34.95 35.15 3k5t s ARG 428 CO 0.79 -0.38 0.83 -0.98 -1.08 0.00 0.00 175.30 174.48 3k5t s ARG 429 N -3.83 0.86 -0.17 3.89 1.70 -1.26 -1.70 118.95 118.44 3k5t s ARG 429 Ca 0.04 0.09 -0.11 0.00 -0.47 0.00 0.00 55.73 55.28 3k5t s ARG 429 Cb 0.03 0.40 0.05 0.00 -0.57 0.00 0.00 34.95 34.86 3k5t s ARG 429 CO -0.11 -0.29 0.42 -1.58 -1.08 0.00 0.00 175.30 172.66 3k5t s HIS 430 N -1.58 -0.56 -0.56 5.89 2.46 -0.42 -4.99 115.29 115.52 3k5t s HIS 430 Ca -0.04 1.25 -0.13 0.00 0.47 0.00 0.00 55.06 56.61 3k5t s HIS 430 Cb -0.00 0.24 0.14 0.00 -0.13 0.00 0.00 32.58 32.82 3k5t s HIS 430 CO 0.03 -0.30 0.49 0.12 -2.47 0.00 0.00 174.74 172.60 3k5t s PHE 431 N 0.97 3.37 -0.95 3.88 2.19 -1.26 -1.66 117.98 124.53 3k5t s PHE 431 Ca -0.06 -1.60 -0.24 0.00 0.33 0.00 0.00 56.93 55.36 3k5t s PHE 431 Cb -0.06 -3.70 0.04 0.00 -1.31 0.00 0.00 43.02 37.99 3k5t s PHE 431 CO -0.08 -1.00 1.43 1.21 1.83 0.00 0.00 175.22 178.61 3k5t s ASN 432 N 3.06 6.37 0.84 6.13 3.84 -0.56 -5.00 114.94 129.61 3k5t s ASN 432 Ca 0.06 -1.18 -0.12 0.00 0.21 0.00 0.00 52.86 51.84 3k5t s ASN 432 Cb -0.26 -2.57 0.10 0.00 -0.55 0.00 0.00 41.25 37.97 3k5t s ASN 432 CO 0.00 -1.63 1.10 -0.55 -2.79 0.00 0.00 177.10 173.23 3k5t s SER 433 N 4.82 4.06 -0.01 -4.21 0.15 -1.26 -0.47 113.70 116.78 3k5t s SER 433 Ca 0.44 1.33 0.08 0.00 0.70 0.00 0.00 55.95 58.50 3k5t s SER 433 Cb -0.02 -2.03 0.23 0.00 -1.71 0.00 0.00 66.02 62.49 3k5t s SER 433 CO -0.04 -2.24 1.18 -0.46 1.20 0.00 0.00 173.24 172.88 3k5t n ASN 434 N -3.61 2.69 -1.49 5.45 0.23 -1.15 -4.44 115.26 112.94 3k5t n ASN 434 Ca 0.07 -2.09 -0.11 0.00 -0.53 0.00 0.00 54.58 51.92 3k5t n ASN 434 Cb 0.56 -0.18 -0.04 0.00 -2.08 0.00 0.00 39.78 38.04 3k5t n ASN 434 CO 0.00 0.00 0.00 0.49 -0.93 0.00 0.00 177.26 176.82 3k5t n PHE 435 N 0.09 -0.62 -2.22 -2.53 3.01 -1.26 -4.67 117.46 109.26 3k5t n PHE 435 Ca 0.09 0.00 0.04 0.00 1.01 0.00 0.00 57.45 58.59 3k5t n PHE 435 Cb 0.41 -2.35 0.06 0.00 -0.01 0.00 0.00 39.48 37.59 3k5t n PHE 435 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 3k5t n LYS 436 N -1.88 0.37 0.00 -1.08 5.02 -1.26 -4.98 118.16 114.34 3k5t n LYS 436 Ca -0.11 -2.19 0.00 0.00 -2.02 0.00 0.00 58.31 53.99 3k5t n LYS 436 Cb 0.40 -0.43 0.00 0.00 -0.02 0.00 0.00 35.03 34.98 3k5t n LYS 436 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3k5t n GLY 437 N 0.06 1.96 0.00 0.72 0.00 -1.26 -5.06 105.19 101.61 3k5t n GLY 437 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 3k5t n GLY 437 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k5t n GLY 438 N -0.66 5.57 3.43 -0.02 0.00 -1.26 -5.06 105.19 107.18 3k5t n GLY 438 Ca 0.00 -1.51 -0.16 0.00 0.00 0.00 0.00 46.02 44.35 3k5t n GLY 438 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3k5t s PHE 439 N 1.02 -0.51 0.03 1.61 -0.00 -1.26 -2.92 117.98 115.96 3k5t s PHE 439 Ca 0.00 0.96 0.05 0.00 -0.00 0.00 0.00 56.93 57.94 3k5t s PHE 439 Cb 0.00 0.27 -0.24 0.00 -0.00 0.00 0.00 43.02 43.05 3k5t s PHE 439 CO 0.00 -0.48 0.96 -0.91 -0.00 0.00 0.00 175.22 174.79 3k5t h ASN 440 N 3.76 0.14 -4.14 1.98 2.35 -0.99 -3.40 115.58 115.28 3k5t h ASN 440 Ca -0.28 -0.20 0.26 0.00 -0.55 0.00 0.00 56.30 55.54 3k5t h ASN 440 Cb 1.16 -0.05 -0.20 0.00 0.05 0.00 0.00 38.32 39.28 3k5t h ASN 440 CO 0.34 1.16 0.84 0.72 -1.65 0.00 0.00 177.43 178.85 3k5t s PHE 441 N -2.65 -0.11 -0.07 1.19 -0.71 -1.16 -4.36 117.98 110.12 3k5t s PHE 441 Ca -0.04 0.08 0.03 0.00 -1.04 0.00 0.00 56.93 55.96 3k5t s PHE 441 Cb 0.08 0.51 -0.02 0.00 -1.21 0.00 0.00 43.02 42.38 3k5t s PHE 441 CO 0.83 -0.16 -0.15 -0.47 -1.34 0.00 0.00 175.22 173.93 3k5t s TYR 442 N -2.24 2.70 0.07 3.49 5.04 -0.90 -1.49 117.35 124.02 3k5t s TYR 442 Ca 0.10 -0.32 0.06 0.00 -2.44 0.00 0.00 57.07 54.47 3k5t s TYR 442 Cb -0.01 -1.68 -0.03 0.00 0.35 0.00 0.00 41.96 40.59 3k5t s TYR 442 CO -0.04 0.06 -0.16 0.00 -1.34 0.00 0.00 175.55 174.06 3k5t s ALA 443 N -0.43 1.39 -0.20 3.97 0.00 -0.66 -0.75 121.76 125.07 3k5t s ALA 443 Ca 0.05 -1.05 -0.29 0.00 0.00 0.00 0.00 51.96 50.67 3k5t s ALA 443 Cb -0.12 -0.17 0.14 0.00 0.00 0.00 0.00 23.12 22.98 3k5t s ALA 443 CO 0.02 0.24 1.09 0.20 0.00 0.00 0.00 175.76 177.31 3k5t s GLY 444 N -1.66 -0.16 -0.34 0.00 0.00 -0.67 -1.30 107.32 103.19 3k5t s GLY 444 Ca 0.01 2.32 -0.01 0.00 0.00 0.00 0.00 44.72 47.05 3k5t s GLY 444 CO 0.03 1.17 0.06 -2.27 0.00 0.00 0.00 173.10 172.09 3k5t s LEU 445 N -0.90 4.45 0.31 0.66 2.96 -0.69 -1.93 118.68 123.55 3k5t s LEU 445 Ca 0.01 -1.69 -0.26 0.00 -0.22 0.00 0.00 54.13 51.97 3k5t s LEU 445 Cb -0.01 -1.72 -0.14 0.00 0.50 0.00 0.00 46.19 44.82 3k5t s LEU 445 CO -0.02 -0.37 0.78 1.17 -1.32 0.00 0.00 176.35 176.60 3k5t n LYS 446 N 4.53 0.86 -3.16 1.98 4.81 -1.26 -0.50 118.16 125.41 3k5t n LYS 446 Ca -0.07 0.30 -0.39 0.00 -0.87 0.00 0.00 58.31 57.29 3k5t n LYS 446 Cb 0.42 -1.59 -0.05 0.00 0.02 0.00 0.00 35.03 33.83 3k5t n LYS 446 CO 0.00 0.00 0.00 0.20 1.17 0.00 0.00 177.40 178.77 3k5t s GLY 447 N -0.77 2.47 0.12 3.14 0.00 -1.20 -4.32 107.32 106.75 3k5t s GLY 447 Ca 0.61 -0.04 0.01 0.00 0.00 0.00 0.00 44.72 45.30 3k5t s GLY 447 CO 0.58 1.03 -0.03 1.20 0.00 0.00 0.00 173.10 175.89 3k5t s GLN 448 N 0.85 0.90 -0.06 2.90 -1.52 -1.26 -1.91 119.66 119.55 3k5t s GLN 448 Ca 0.32 -1.39 -0.20 0.00 -1.95 0.00 0.00 55.36 52.14 3k5t s GLN 448 Cb -0.16 -0.11 0.04 0.00 -0.22 0.00 0.00 33.01 32.56 3k5t s GLN 448 CO 0.14 -0.09 0.46 0.54 -0.25 0.00 0.00 175.29 176.09 3k5t s VAL 449 N -3.72 0.03 -0.22 1.09 0.11 -0.44 -4.37 120.40 112.87 3k5t s VAL 449 Ca 0.16 -0.22 -0.11 0.00 -2.93 0.00 0.00 61.98 58.88 3k5t s VAL 449 Cb 0.06 -0.75 -0.05 0.00 -1.53 0.00 0.00 36.38 34.12 3k5t s VAL 449 CO -0.02 -0.12 0.19 -0.22 -3.33 0.00 0.00 175.10 171.60 3k5t s LEU 450 N -0.92 4.15 -0.21 2.54 2.96 -0.75 -1.11 118.68 125.34 3k5t s LEU 450 Ca -0.10 0.22 -0.02 0.00 -0.22 0.00 0.00 54.13 54.01 3k5t s LEU 450 Cb -0.03 -2.17 0.00 0.00 0.50 0.00 0.00 46.19 44.49 3k5t s LEU 450 CO 0.05 0.08 -0.09 -0.69 -1.32 0.00 0.00 176.35 174.38 3k5t s VAL 451 N 0.87 2.93 -0.35 1.68 1.01 0.38 -0.67 120.40 126.25 3k5t s VAL 451 Ca 0.10 -0.66 -0.18 0.00 0.00 0.00 0.00 61.98 61.24 3k5t s VAL 451 Cb -0.13 -2.32 -0.00 0.00 0.00 0.00 0.00 36.38 33.93 3k5t s VAL 451 CO 0.03 0.45 0.51 -0.22 0.00 0.00 0.00 175.10 175.87 3k5t s LEU 452 N 1.41 4.35 0.00 3.92 2.96 0.18 -1.93 118.68 129.57 3k5t s LEU 452 Ca 0.05 -0.03 0.06 0.00 -0.22 0.00 0.00 54.13 53.99 3k5t s LEU 452 Cb -0.14 -2.58 -0.02 0.00 0.50 0.00 0.00 46.19 43.96 3k5t s LEU 452 CO -0.06 -0.47 -0.17 -0.60 -1.32 0.00 0.00 176.35 173.72 3k5t s ARG 453 N 2.38 1.35 0.33 1.98 3.52 -0.29 -1.10 118.95 127.11 3k5t s ARG 453 Ca 0.18 -0.67 0.07 0.00 -0.13 0.00 0.00 55.73 55.18 3k5t s ARG 453 Cb -0.15 -1.33 -0.03 0.00 -1.56 0.00 0.00 34.95 31.88 3k5t s ARG 453 CO 0.13 0.36 0.26 -0.08 -0.81 0.00 0.00 175.30 175.16 3k5t s THR 454 N -0.50 0.05 0.22 4.11 -1.32 -0.95 -0.92 115.64 116.33 3k5t s THR 454 Ca 0.06 -2.00 0.05 0.00 -1.21 0.00 0.00 61.69 58.59 3k5t s THR 454 Cb -0.07 -2.48 -0.05 0.00 -1.51 0.00 0.00 72.50 68.38 3k5t s THR 454 CO -0.00 0.00 -0.05 0.42 -2.21 0.00 0.00 174.62 172.78 3k5t s THR 455 N -3.46 1.26 -0.09 5.08 -4.23 -1.26 -0.55 115.64 112.38 3k5t s THR 455 Ca 0.39 -2.07 0.01 0.00 -1.18 0.00 0.00 61.69 58.84 3k5t s THR 455 Cb 0.03 -2.25 0.02 0.00 1.34 0.00 0.00 72.50 71.63 3k5t s THR 455 CO 0.26 -0.42 -0.09 -0.94 -0.54 0.00 0.00 174.62 172.89 3k5t s SER 456 N -3.31 1.89 -0.38 3.99 1.04 0.98 -4.00 113.70 113.92 3k5t s SER 456 Ca 0.26 -0.28 0.01 0.00 0.48 0.00 0.00 55.95 56.43 3k5t s SER 456 Cb 0.04 -0.79 0.12 0.00 0.10 0.00 0.00 66.02 65.49 3k5t s SER 456 CO 0.08 -0.06 0.15 -0.89 0.98 0.00 0.00 173.24 173.51 3k5t s THR 457 N 1.24 1.39 0.03 2.02 2.01 -0.82 -0.29 115.64 121.21 3k5t s THR 457 Ca -0.04 -2.11 -0.17 0.00 0.31 0.00 0.00 61.69 59.68 3k5t s THR 457 Cb -0.14 -2.01 -0.29 0.00 0.01 0.00 0.00 72.50 70.07 3k5t s THR 457 CO -0.03 -0.76 1.06 0.58 -0.69 0.00 0.00 174.62 174.79 3k5t h VAL 458 N 5.96 1.35 0.00 3.82 2.07 -1.95 -3.46 116.25 124.04 3k5t h VAL 458 Ca -0.07 -2.40 0.00 0.00 0.82 0.00 0.00 66.70 65.05 3k5t h VAL 458 Cb 0.97 2.77 0.00 0.00 -1.52 0.00 0.00 31.29 33.51 3k5t h VAL 458 CO 0.49 0.72 0.00 0.00 0.02 0.00 0.00 177.57 178.80 3k5t n TYR 459 N -3.93 0.00 1.77 1.57 9.36 -1.26 -5.11 117.16 119.56 3k5t n TYR 459 Ca -0.13 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.09 3k5t n TYR 459 Cb 0.90 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.61 3k5t n TYR 459 CO 0.00 0.00 0.00 0.27 0.22 0.00 0.00 176.86 177.35 3k5t n ASN 460 N 0.00 0.18 -3.24 2.98 6.94 -1.26 -4.95 115.26 115.91 3k5t n ASN 460 Ca 0.00 -1.96 0.04 0.00 -0.02 0.00 0.00 54.58 52.64 3k5t n ASN 460 Cb 0.00 -0.09 -0.02 0.00 -2.36 0.00 0.00 39.78 37.31 3k5t n ASN 460 CO 0.00 0.00 0.00 -1.81 -1.03 0.00 0.00 177.26 174.42 3k5t s ASP 462 N -0.83 -0.86 -0.25 0.53 1.11 0.74 0.93 116.67 118.04 3k5t s ASP 462 Ca 0.00 0.70 -0.10 0.00 0.18 0.00 0.00 52.55 53.33 3k5t s ASP 462 Cb 0.00 1.79 -0.05 0.00 1.07 0.00 0.00 42.92 45.73 3k5t s ASP 462 CO 0.00 -0.16 0.15 -0.31 1.18 0.00 0.00 175.17 176.02 3k5t s TYR 463 N 2.82 3.23 -0.39 4.23 2.02 0.60 -0.36 117.35 129.50 3k5t s TYR 463 Ca 0.06 0.06 -0.20 0.00 -0.37 0.00 0.00 57.07 56.62 3k5t s TYR 463 Cb -0.11 -2.29 0.01 0.00 -0.40 0.00 0.00 41.96 39.17 3k5t s TYR 463 CO -0.16 -0.09 0.59 0.42 -1.57 0.00 0.00 175.55 174.73 3k5t s ILE 464 N 1.37 4.92 -0.18 2.71 1.01 -0.31 -0.01 121.20 130.70 3k5t s ILE 464 Ca 0.07 0.26 -0.15 0.00 0.00 0.00 0.00 60.65 60.83 3k5t s ILE 464 Cb -0.15 -4.09 -0.04 0.00 0.01 0.00 0.00 42.46 38.19 3k5t s ILE 464 CO 0.07 -0.40 0.34 0.26 0.00 0.00 0.00 174.94 175.21 3k5t s TRP 465 N 2.61 3.42 -0.04 3.97 0.52 0.28 -1.52 118.94 128.18 3k5t s TRP 465 Ca 0.21 0.59 0.05 0.00 0.02 0.00 0.00 56.10 56.98 3k5t s TRP 465 Cb -0.15 -2.43 -0.01 0.00 -1.15 0.00 0.00 33.47 29.73 3k5t s TRP 465 CO 0.16 0.11 -0.20 -0.51 0.02 0.00 0.00 176.95 176.53 3k5t s ASP 466 N 0.77 2.44 -0.12 2.95 1.01 0.96 -2.24 116.67 122.45 3k5t s ASP 466 Ca 0.18 -0.40 0.02 0.00 0.71 0.00 0.00 52.55 53.06 3k5t s ASP 466 Cb -0.14 -0.58 0.01 0.00 1.01 0.00 0.00 42.92 43.23 3k5t s ASP 466 CO 0.06 0.20 -0.17 -0.36 0.21 0.00 0.00 175.17 175.11 3k5t s PHE 467 N -0.14 2.20 -0.05 4.23 2.99 -0.26 -1.34 117.98 125.62 3k5t s PHE 467 Ca -0.01 -1.06 0.03 0.00 0.00 0.00 0.00 56.93 55.89 3k5t s PHE 467 Cb -0.11 -1.55 0.01 0.00 0.00 0.00 0.00 43.02 41.36 3k5t s PHE 467 CO 0.02 -0.52 -0.14 0.42 -0.00 0.00 0.00 175.22 175.00 3k5t s ILE 468 N 0.93 1.23 -0.21 0.64 1.01 -0.13 0.48 121.20 125.14 3k5t s ILE 468 Ca -0.07 -0.57 0.01 0.00 0.00 0.00 0.00 60.65 60.02 3k5t s ILE 468 Cb -0.15 -1.09 0.05 0.00 0.01 0.00 0.00 42.46 41.28 3k5t s ILE 468 CO -0.02 0.37 -0.08 -0.36 0.00 0.00 0.00 174.94 174.85 3k5t s PHE 469 N 0.36 2.41 0.33 3.97 0.40 0.15 -0.17 117.98 125.43 3k5t s PHE 469 Ca -0.09 -1.66 -0.09 0.00 -0.60 0.00 0.00 56.93 54.48 3k5t s PHE 469 Cb -0.13 -1.61 -0.07 0.00 0.51 0.00 0.00 43.02 41.72 3k5t s PHE 469 CO 0.03 -0.75 0.67 0.71 0.70 0.00 0.00 175.22 176.57 3k5t s TYR 470 N 1.39 3.45 0.48 0.36 1.51 0.44 -1.81 117.35 123.17 3k5t s TYR 470 Ca -0.03 0.92 0.37 0.00 -1.01 0.00 0.00 57.07 57.32 3k5t s TYR 470 Cb -0.17 -2.33 1.94 0.00 -0.11 0.00 0.00 41.96 41.29 3k5t s TYR 470 CO -0.07 0.06 2.21 -1.35 -1.11 0.00 0.00 175.55 175.30 3k5t h PRO 471 N 1.73 0.00 -0.84 -1.71 0.11 -1.87 -2.88 132.00 126.55 3k5t h PRO 471 Ca -0.47 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.51 3k5t h PRO 471 Cb 1.18 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 32.22 3k5t h PRO 471 CO 0.66 0.02 0.16 0.27 -0.21 0.00 0.00 178.00 178.90 3k5t n ASN 472 N -3.26 3.78 0.00 -2.05 6.94 -1.26 -4.24 115.26 115.17 3k5t n ASN 472 Ca -0.02 -2.74 0.00 0.00 -0.02 0.00 0.00 54.58 51.80 3k5t n ASN 472 Cb 0.16 -0.65 0.00 0.00 -2.36 0.00 0.00 39.78 36.93 3k5t n ASN 472 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3k5t n GLY 473 N 0.04 1.58 3.71 4.83 0.00 -1.09 -4.59 105.19 109.68 3k5t n GLY 473 Ca 0.25 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.85 3k5t n GLY 473 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3k5t s VAL 474 N -3.34 4.50 0.02 1.61 1.01 -1.26 -4.40 120.40 118.54 3k5t s VAL 474 Ca 0.00 1.79 0.06 0.00 0.00 0.00 0.00 61.98 63.84 3k5t s VAL 474 Cb 0.00 -4.15 -0.03 0.00 0.00 0.00 0.00 36.38 32.20 3k5t s VAL 474 CO 0.00 0.14 -0.17 -0.32 0.00 0.00 0.00 175.10 174.74 3k5t s MET 475 N 1.06 2.17 0.09 2.72 1.75 -0.47 -0.42 119.30 126.20 3k5t s MET 475 Ca 0.55 -0.91 0.07 0.00 -1.25 0.00 0.00 55.69 54.14 3k5t s MET 475 Cb -0.25 -2.23 -0.03 0.00 2.84 0.00 0.00 34.83 35.16 3k5t s MET 475 CO 0.28 0.56 -0.17 -2.00 -0.65 0.00 0.00 175.02 173.04 3k5t s GLU 476 N -1.27 0.97 -0.08 4.11 2.12 0.76 0.11 118.70 125.41 3k5t s GLU 476 Ca 0.14 -1.06 0.04 0.00 0.36 0.00 0.00 54.97 54.44 3k5t s GLU 476 Cb -0.11 -1.09 0.00 0.00 0.26 0.00 0.00 34.13 33.20 3k5t s GLU 476 CO 0.04 0.25 -0.20 0.00 -0.54 0.00 0.00 175.26 174.81 3k5t s ALA 477 N -1.27 1.86 0.00 6.30 0.00 0.25 -0.96 121.76 127.95 3k5t s ALA 477 Ca 0.02 -0.80 0.01 0.00 0.00 0.00 0.00 51.96 51.20 3k5t s ALA 477 Cb -0.10 -0.71 -0.01 0.00 0.00 0.00 0.00 23.12 22.31 3k5t s ALA 477 CO 0.03 0.25 -0.03 0.15 0.00 0.00 0.00 175.76 176.16 3k5t s LYS 478 N 0.37 0.25 -0.09 0.00 1.02 -0.45 -1.39 119.74 119.46 3k5t s LYS 478 Ca -0.16 -0.21 0.04 0.00 0.02 0.00 0.00 55.97 55.66 3k5t s LYS 478 Cb -0.17 -0.18 0.00 0.00 -0.52 0.00 0.00 37.83 36.97 3k5t s LYS 478 CO 0.07 0.04 -0.21 1.41 -0.92 0.00 0.00 175.35 175.74 3k5t s MET 479 N -0.36 2.62 -0.10 1.68 -2.45 0.03 -0.03 119.30 120.69 3k5t s MET 479 Ca -0.02 -0.75 0.01 0.00 -1.25 0.00 0.00 55.69 53.68 3k5t s MET 479 Cb -0.03 -2.03 -0.02 0.00 1.25 0.00 0.00 34.83 34.00 3k5t s MET 479 CO -0.00 0.16 -0.12 -1.01 1.05 0.00 0.00 175.02 175.10 3k5t s HIS 480 N 0.38 2.81 -0.15 4.11 0.09 -0.57 -1.82 115.29 120.12 3k5t s HIS 480 Ca -0.16 -0.36 -0.07 0.00 -0.00 0.00 0.00 55.06 54.46 3k5t s HIS 480 Cb -0.17 -1.76 -0.04 0.00 -0.00 0.00 0.00 32.58 30.61 3k5t s HIS 480 CO 0.07 0.01 0.10 0.00 -0.00 0.00 0.00 174.74 174.93 3k5t s ALA 481 N -0.17 3.66 0.00 -1.40 0.00 -0.56 -1.17 121.76 122.12 3k5t s ALA 481 Ca 0.00 -0.69 0.00 0.00 0.00 0.00 0.00 51.96 51.27 3k5t s ALA 481 Cb -0.13 -1.96 0.00 0.00 0.00 0.00 0.00 23.12 21.03 3k5t s ALA 481 CO 0.03 0.39 0.00 -2.37 0.00 0.00 0.00 175.76 173.81 3k5t n THR 482 N 2.76 0.00 -1.51 0.00 5.66 0.51 -3.84 114.28 117.86 3k5t n THR 482 Ca -0.18 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.82 3k5t n THR 482 Cb 0.53 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.31 3k5t n THR 482 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3k5t n GLY 483 N 0.00 -1.43 3.79 1.09 0.00 -1.20 -0.18 105.19 107.25 3k5t n GLY 483 Ca 0.00 -1.71 -0.38 0.00 0.00 0.00 0.00 46.02 43.93 3k5t n GLY 483 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3k5t s TYR 484 N 0.00 3.66 0.77 1.61 1.51 0.26 -0.83 117.35 124.34 3k5t s TYR 484 Ca 0.00 0.99 -0.11 0.00 -1.01 0.00 0.00 57.07 56.94 3k5t s TYR 484 Cb 0.00 -2.42 0.05 0.00 -0.11 0.00 0.00 41.96 39.49 3k5t s TYR 484 CO 0.00 0.45 1.08 0.14 -1.11 0.00 0.00 175.55 176.12 3k5t s VAL 485 N -0.43 3.40 -0.27 0.71 -7.23 -1.26 -4.67 120.40 110.65 3k5t s VAL 485 Ca 0.25 0.45 -0.19 0.00 -1.81 0.00 0.00 61.98 60.69 3k5t s VAL 485 Cb -0.16 -3.02 -0.02 0.00 0.56 0.00 0.00 36.38 33.73 3k5t s VAL 485 CO 0.13 -0.59 0.56 -2.28 -0.31 0.00 0.00 175.10 172.61 3k5t s HIS 486 N -2.96 3.26 0.10 2.82 2.46 -1.26 -4.87 115.29 114.84 3k5t s HIS 486 Ca 0.61 0.67 0.01 0.00 0.47 0.00 0.00 55.06 56.81 3k5t s HIS 486 Cb -0.16 -2.79 -0.04 0.00 -0.13 0.00 0.00 32.58 29.45 3k5t s HIS 486 CO 0.56 -0.33 -0.04 0.00 -2.47 0.00 0.00 174.74 172.47 3k5t s ALA 487 N 2.40 0.89 0.16 1.58 0.00 -1.26 -3.59 121.76 121.94 3k5t s ALA 487 Ca 0.23 -1.35 0.00 0.00 0.00 0.00 0.00 51.96 50.84 3k5t s ALA 487 Cb -0.15 0.30 -0.04 0.00 0.00 0.00 0.00 23.12 23.22 3k5t s ALA 487 CO 0.09 -0.31 0.05 0.95 0.00 0.00 0.00 175.76 176.55 3k5t s THR 488 N -3.75 0.34 0.31 0.00 -4.23 -0.34 -4.92 115.64 103.05 3k5t s THR 488 Ca 0.13 -1.95 -0.29 0.00 -1.18 0.00 0.00 61.69 58.40 3k5t s THR 488 Cb 0.06 -2.17 -0.11 0.00 1.34 0.00 0.00 72.50 71.63 3k5t s THR 488 CO -0.05 -0.39 1.47 0.12 -0.54 0.00 0.00 174.62 175.24 3k5t s PHE 489 N -3.89 2.84 -0.10 3.99 5.36 -1.26 0.09 117.98 125.01 3k5t s PHE 489 Ca 0.27 1.06 -0.30 0.00 -0.96 0.00 0.00 56.93 57.00 3k5t s PHE 489 Cb 0.07 -3.92 -0.03 0.00 -0.34 0.00 0.00 43.02 38.80 3k5t s PHE 489 CO 0.04 -2.87 1.24 -0.47 -1.46 0.00 0.00 175.22 171.70 3k5t s TYR 490 N -0.49 3.02 0.19 10.12 6.14 -0.32 -4.56 117.35 131.45 3k5t s TYR 490 Ca 0.57 1.10 0.07 0.00 0.64 0.00 0.00 57.07 59.45 3k5t s TYR 490 Cb -0.44 -3.47 -0.05 0.00 0.42 0.00 0.00 41.96 38.42 3k5t s TYR 490 CO 0.51 -1.55 -0.14 0.95 0.64 0.00 0.00 175.55 175.96 3k5t s THR 491 N 2.77 1.66 0.42 4.34 -4.23 -1.26 -4.90 115.64 114.43 3k5t s THR 491 Ca 0.56 -2.16 0.17 0.00 -1.18 0.00 0.00 61.69 59.07 3k5t s THR 491 Cb -0.24 -1.99 0.19 0.00 1.34 0.00 0.00 72.50 71.79 3k5t s THR 491 CO 0.19 -0.60 1.97 -0.65 -0.54 0.00 0.00 174.62 175.00 3k5t h PRO 492 N 2.65 0.00 0.00 3.99 0.11 -2.01 -2.32 132.00 134.42 3k5t h PRO 492 Ca -0.38 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.73 3k5t h PRO 492 Cb 1.22 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 3k5t h PRO 492 CO 0.61 0.21 -0.02 0.93 -0.21 0.00 0.00 178.00 179.53 3k5t h GLU 493 N 0.00 0.00 0.00 1.05 5.08 -2.00 -2.87 114.58 115.84 3k5t h GLU 493 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3k5t h GLU 493 Cb 0.40 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.65 3k5t h GLU 493 CO 0.03 0.02 0.00 0.41 -1.00 0.00 0.00 179.01 178.46 3k5t n GLY 494 N -0.90 -1.05 0.00 -3.84 0.00 -0.87 -3.12 105.19 95.41 3k5t n GLY 494 Ca -0.02 -0.16 0.14 0.00 0.00 0.00 0.00 46.02 45.97 3k5t n GLY 494 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3k5t n LEU 495 N -1.12 0.03 -0.92 0.99 4.77 -1.08 -2.20 117.00 117.46 3k5t n LEU 495 Ca 0.18 0.50 0.07 0.00 -0.03 0.00 0.00 56.01 56.73 3k5t n LEU 495 Cb 0.15 -0.49 0.21 0.00 -2.33 0.00 0.00 43.42 40.96 3k5t n LEU 495 CO 0.19 -0.02 0.67 -2.11 -1.33 0.00 0.00 177.39 174.79 3k5t n ARG 496 N -1.53 2.25 -1.78 3.23 1.85 -1.18 -3.97 116.66 115.54 3k5t n ARG 496 Ca 0.07 -1.69 0.03 0.00 -1.00 0.00 0.00 57.85 55.25 3k5t n ARG 496 Cb 0.34 -1.44 0.04 0.00 -1.05 0.00 0.00 32.46 30.34 3k5t n ARG 496 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 3k5t n HIS 497 N 0.78 0.34 -0.98 2.89 8.25 -0.93 -4.97 115.22 120.60 3k5t n HIS 497 Ca 0.16 -0.97 0.00 0.00 -0.26 0.00 0.00 57.72 56.65 3k5t n HIS 497 Cb 0.45 -0.18 0.00 0.00 1.12 0.00 0.00 29.99 31.38 3k5t n HIS 497 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3k5t n GLY 498 N 0.13 0.55 3.01 -1.41 0.00 -1.15 -1.07 105.19 105.25 3k5t n GLY 498 Ca 0.08 -1.63 -0.19 0.00 0.00 0.00 0.00 46.02 44.28 3k5t n GLY 498 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3k5t s THR 499 N -3.13 0.69 -0.27 2.61 2.01 -0.84 -4.44 115.64 112.28 3k5t s THR 499 Ca 0.00 -0.36 -0.29 0.00 0.31 0.00 0.00 61.69 61.35 3k5t s THR 499 Cb 0.00 -0.59 -0.01 0.00 0.01 0.00 0.00 72.50 71.91 3k5t s THR 499 CO 0.00 0.20 1.53 -0.60 -0.69 0.00 0.00 174.62 175.06 3k5t s ARG 500 N -0.13 3.75 0.04 4.92 3.52 -1.26 0.12 118.95 129.91 3k5t s ARG 500 Ca 0.02 1.45 0.22 0.00 -0.13 0.00 0.00 55.73 57.30 3k5t s ARG 500 Cb -0.04 -4.01 -0.23 0.00 -1.56 0.00 0.00 34.95 29.10 3k5t s ARG 500 CO -0.00 -1.34 0.66 1.28 -0.81 0.00 0.00 175.30 175.09 3k5t n LEU 501 N 8.47 0.27 -3.79 -0.88 4.77 0.23 -4.79 117.00 121.28 3k5t n LEU 501 Ca 0.18 0.08 -0.04 0.00 -0.03 0.00 0.00 56.01 56.20 3k5t n LEU 501 Cb 0.46 -0.02 -0.01 0.00 -2.33 0.00 0.00 43.42 41.52 3k5t n LEU 501 CO 0.65 -0.05 0.67 -2.28 -1.33 0.00 0.00 177.39 175.05 3k5t s HIS 502 N -3.46 -0.12 0.19 -1.77 2.46 -1.20 -4.90 115.29 106.50 3k5t s HIS 502 Ca -0.05 -0.25 -0.16 0.00 0.47 0.00 0.00 55.06 55.07 3k5t s HIS 502 Cb 0.13 0.67 0.19 0.00 -0.13 0.00 0.00 32.58 33.43 3k5t s HIS 502 CO 0.87 -0.96 1.34 2.41 -2.47 0.00 0.00 174.74 175.94 3k5t n THR 503 N -0.49 -0.47 -1.11 0.89 -1.04 -1.26 -1.41 114.28 109.39 3k5t n THR 503 Ca -0.05 2.03 0.05 0.00 -2.04 0.00 0.00 64.05 64.04 3k5t n THR 503 Cb 0.60 -2.67 0.24 0.00 -1.82 0.00 0.00 70.33 66.68 3k5t n THR 503 CO 0.00 0.00 0.00 1.41 -0.64 0.00 0.00 175.07 175.84 3k5t n HIS 504 N -5.26 0.98 -3.93 -1.42 8.25 -1.26 -4.82 115.22 107.75 3k5t n HIS 504 Ca 0.08 -1.08 -0.28 0.00 -0.26 0.00 0.00 57.72 56.18 3k5t n HIS 504 Cb 0.34 -0.36 -0.16 0.00 1.12 0.00 0.00 29.99 30.92 3k5t n HIS 504 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 3k5t s LEU 505 N -2.95 1.61 -0.25 2.41 2.96 -0.50 -1.18 118.68 120.79 3k5t s LEU 505 Ca 0.43 -0.56 -0.10 0.00 -0.22 0.00 0.00 54.13 53.67 3k5t s LEU 505 Cb 0.36 -0.99 -0.05 0.00 0.50 0.00 0.00 46.19 46.01 3k5t s LEU 505 CO 0.06 -0.14 0.14 -0.63 -1.32 0.00 0.00 176.35 174.47 3k5t s ILE 506 N 1.59 5.12 -0.63 6.68 -1.09 0.11 0.77 121.20 133.75 3k5t s ILE 506 Ca 0.02 0.10 -0.25 0.00 -2.23 0.00 0.00 60.65 58.29 3k5t s ILE 506 Cb -0.14 -3.40 0.04 0.00 -1.58 0.00 0.00 42.46 37.39 3k5t s ILE 506 CO -0.08 0.33 1.07 -0.83 -1.23 0.00 0.00 174.94 174.19 3k5t s GLY 507 N 1.28 1.23 0.33 6.18 0.00 0.33 -1.20 107.32 115.47 3k5t s GLY 507 Ca 0.07 -1.37 -0.29 0.00 0.00 0.00 0.00 44.72 43.13 3k5t s GLY 507 CO 0.06 2.26 1.46 -1.31 0.00 0.00 0.00 173.10 175.57 3k5t s ASN 508 N 3.30 6.49 0.41 1.64 -0.87 -1.24 -1.98 114.94 122.68 3k5t s ASN 508 Ca 0.31 2.90 -0.27 0.00 -1.57 0.00 0.00 52.86 54.23 3k5t s ASN 508 Cb -0.12 -2.65 -0.09 0.00 -0.02 0.00 0.00 41.25 38.37 3k5t s ASN 508 CO 0.17 -0.78 1.39 -0.51 -2.57 0.00 0.00 177.10 174.80 3k5t s ILE 509 N -0.75 2.31 0.11 0.60 2.07 -0.23 -4.51 121.20 120.80 3k5t s ILE 509 Ca 0.55 0.28 -0.26 0.00 -1.41 0.00 0.00 60.65 59.82 3k5t s ILE 509 Cb -0.45 -3.17 0.07 0.00 0.13 0.00 0.00 42.46 39.05 3k5t s ILE 509 CO 0.55 0.05 0.84 -1.38 -1.91 0.00 0.00 174.94 173.09 3k5t s HIS 510 N -1.19 -0.29 -0.13 3.50 -3.43 -0.99 -1.96 115.29 110.79 3k5t s HIS 510 Ca 0.56 0.05 -0.00 0.00 -0.80 0.00 0.00 55.06 54.87 3k5t s HIS 510 Cb -0.42 0.60 -0.01 0.00 -1.43 0.00 0.00 32.58 31.31 3k5t s HIS 510 CO 0.55 -0.77 -0.13 0.99 -2.00 0.00 0.00 174.74 173.38 3k5t s THR 511 N -3.38 3.04 -0.21 -5.38 2.01 -0.50 0.66 115.64 111.88 3k5t s THR 511 Ca 0.07 -0.66 -0.19 0.00 0.31 0.00 0.00 61.69 61.22 3k5t s THR 511 Cb -0.02 -2.28 -0.03 0.00 0.01 0.00 0.00 72.50 70.18 3k5t s THR 511 CO -0.04 0.52 0.53 -1.00 -0.69 0.00 0.00 174.62 173.94 3k5t s HIS 512 N 0.40 3.36 -0.03 4.92 3.76 0.20 -2.15 115.29 125.75 3k5t s HIS 512 Ca -0.10 0.77 0.02 0.00 -0.15 0.00 0.00 55.06 55.60 3k5t s HIS 512 Cb -0.16 -2.69 0.01 0.00 1.11 0.00 0.00 32.58 30.84 3k5t s HIS 512 CO 0.05 -0.14 -0.09 -0.51 -0.85 0.00 0.00 174.74 173.20 3k5t s LEU 513 N 1.78 1.72 -0.05 0.89 1.43 -0.95 0.52 118.68 124.02 3k5t s LEU 513 Ca 0.24 -0.19 0.05 0.00 -1.03 0.00 0.00 54.13 53.20 3k5t s LEU 513 Cb -0.15 -0.57 -0.01 0.00 0.03 0.00 0.00 46.19 45.49 3k5t s LEU 513 CO 0.10 0.05 -0.19 -0.69 0.23 0.00 0.00 176.35 175.84 3k5t s VAL 514 N 0.33 1.61 -0.20 -1.59 1.01 0.20 -0.46 120.40 121.30 3k5t s VAL 514 Ca -0.05 -0.82 -0.05 0.00 0.00 0.00 0.00 61.98 61.05 3k5t s VAL 514 Cb -0.10 -1.37 -0.03 0.00 0.00 0.00 0.00 36.38 34.88 3k5t s VAL 514 CO 0.01 0.46 0.01 -2.28 0.00 0.00 0.00 175.10 173.30 3k5t s HIS 515 N -0.03 3.06 0.06 5.22 2.46 -0.04 -1.51 115.29 124.52 3k5t s HIS 515 Ca -0.03 -0.42 0.01 0.00 0.47 0.00 0.00 55.06 55.09 3k5t s HIS 515 Cb -0.12 -2.10 -0.04 0.00 -0.13 0.00 0.00 32.58 30.19 3k5t s HIS 515 CO 0.03 -0.23 0.14 0.71 -2.47 0.00 0.00 174.74 172.92 3k5t s TYR 516 N 1.03 3.35 -0.24 3.88 1.51 0.98 0.04 117.35 127.89 3k5t s TYR 516 Ca 0.02 0.17 -0.06 0.00 -1.01 0.00 0.00 57.07 56.20 3k5t s TYR 516 Cb -0.14 -1.69 -0.01 0.00 -0.11 0.00 0.00 41.96 40.00 3k5t s TYR 516 CO 0.02 0.56 0.02 0.50 -1.11 0.00 0.00 175.55 175.53 3k5t s ARG 517 N -2.39 3.44 -0.66 -0.62 3.52 -0.17 -1.70 118.95 120.38 3k5t s ARG 517 Ca 0.31 -0.60 0.05 0.00 -0.13 0.00 0.00 55.73 55.36 3k5t s ARG 517 Cb -0.13 -3.18 0.19 0.00 -1.56 0.00 0.00 34.95 30.28 3k5t s ARG 517 CO 0.24 -0.23 0.56 0.28 -0.81 0.00 0.00 175.30 175.34 3k5t n VAL 518 N 4.85 1.57 -1.45 7.11 0.31 0.13 -1.65 118.33 129.20 3k5t n VAL 518 Ca -0.17 -4.84 -0.42 0.00 -0.01 0.00 0.00 64.34 58.90 3k5t n VAL 518 Cb 0.51 -2.12 -0.04 0.00 -0.91 0.00 0.00 33.84 31.28 3k5t n VAL 518 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 3k5t n ASP 519 N 1.69 3.09 -4.71 4.52 2.03 0.26 -1.39 116.55 122.06 3k5t n ASP 519 Ca 0.23 -2.74 -0.42 0.00 0.52 0.00 0.00 54.79 52.38 3k5t n ASP 519 Cb 0.38 -1.36 -0.03 0.00 -0.72 0.00 0.00 41.12 39.40 3k5t n ASP 519 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 3k5t s LEU 520 N 2.23 4.37 -0.67 -2.67 1.43 -1.26 -1.37 118.68 120.73 3k5t s LEU 520 Ca 0.55 2.54 0.05 0.00 -1.03 0.00 0.00 54.13 56.24 3k5t s LEU 520 Cb 0.13 -3.58 0.20 0.00 0.03 0.00 0.00 46.19 42.97 3k5t s LEU 520 CO 0.05 -0.83 0.58 0.47 0.23 0.00 0.00 176.35 176.85 3k5t n ASP 521 N 4.51 3.15 -4.65 2.29 9.92 0.53 -4.59 116.55 127.71 3k5t n ASP 521 Ca 0.14 -3.27 -0.43 0.00 -0.53 0.00 0.00 54.79 50.71 3k5t n ASP 521 Cb 0.40 -0.72 -0.02 0.00 -0.64 0.00 0.00 41.12 40.13 3k5t n ASP 521 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 3k5t s VAL 522 N -1.79 3.85 -0.76 2.53 1.01 -1.21 -2.15 120.40 121.88 3k5t s VAL 522 Ca 0.31 1.01 0.00 0.00 0.00 0.00 0.00 61.98 63.29 3k5t s VAL 522 Cb 0.03 -3.73 0.00 0.00 0.00 0.00 0.00 36.38 32.68 3k5t s VAL 522 CO -0.11 -0.18 0.00 0.00 0.00 0.00 0.00 175.10 174.81 3k5t n ALA 523 N 7.41 -0.41 0.00 5.51 0.00 -0.51 -4.51 120.51 128.01 3k5t n ALA 523 Ca 0.17 0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.71 3k5t n ALA 523 Cb 0.44 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.89 3k5t n ALA 523 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3k5t n GLY 524 N -0.36 1.63 0.26 0.00 0.00 -0.91 -4.86 105.19 100.95 3k5t n GLY 524 Ca -0.08 -1.84 -0.11 0.00 0.00 0.00 0.00 46.02 43.98 3k5t n GLY 524 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3k5t h THR 525 N 3.72 1.28 -3.38 2.61 2.02 -1.85 -3.40 112.91 113.92 3k5t h THR 525 Ca 0.00 -1.31 -0.59 0.00 0.77 0.00 0.00 66.41 65.27 3k5t h THR 525 Cb 0.00 1.21 -0.09 0.00 -1.74 0.00 0.00 68.15 67.53 3k5t h THR 525 CO 0.00 0.44 0.26 -0.54 0.37 0.00 0.00 175.52 176.06 3k5t s LYS 526 N -4.69 4.20 0.24 6.66 -0.14 -1.26 -3.64 119.74 121.11 3k5t s LYS 526 Ca -0.12 0.76 0.01 0.00 -1.36 0.00 0.00 55.97 55.25 3k5t s LYS 526 Cb 0.11 -3.61 -0.05 0.00 -1.68 0.00 0.00 37.83 32.61 3k5t s LYS 526 CO 0.85 -0.35 0.12 -0.80 -0.76 0.00 0.00 175.35 174.40 3k5t s ASN 527 N 1.27 0.80 0.24 2.83 0.02 -0.42 -4.66 114.94 115.02 3k5t s ASN 527 Ca 0.32 -1.40 0.06 0.00 -1.02 0.00 0.00 52.86 50.81 3k5t s ASN 527 Cb -0.16 0.27 -0.05 0.00 0.02 0.00 0.00 41.25 41.33 3k5t s ASN 527 CO 0.10 -0.79 -0.06 -0.44 0.02 0.00 0.00 177.10 175.93 3k5t s SER 528 N -3.26 2.32 -0.08 -1.22 0.01 -0.65 -0.89 113.70 109.93 3k5t s SER 528 Ca 0.38 -1.15 0.04 0.00 1.31 0.00 0.00 55.95 56.53 3k5t s SER 528 Cb 0.07 -0.09 -0.01 0.00 0.21 0.00 0.00 66.02 66.20 3k5t s SER 528 CO 0.13 -0.37 -0.21 0.12 0.41 0.00 0.00 173.24 173.32 3k5t s PHE 529 N -3.17 2.57 0.09 2.43 5.36 -1.26 0.26 117.98 124.25 3k5t s PHE 529 Ca 0.27 -0.72 -0.03 0.00 -0.96 0.00 0.00 56.93 55.49 3k5t s PHE 529 Cb 0.04 -1.68 -0.03 0.00 -0.34 0.00 0.00 43.02 41.01 3k5t s PHE 529 CO 0.09 -0.22 0.05 1.14 -1.46 0.00 0.00 175.22 174.82 3k5t s GLN 530 N -0.01 0.78 0.07 10.12 -2.07 -0.36 -3.24 119.66 124.95 3k5t s GLN 530 Ca -0.07 -1.24 0.04 0.00 -1.82 0.00 0.00 55.36 52.27 3k5t s GLN 530 Cb -0.15 0.25 -0.03 0.00 -1.09 0.00 0.00 33.01 31.99 3k5t s GLN 530 CO 0.05 -0.20 -0.11 0.95 -1.32 0.00 0.00 175.29 174.66 3k5t s THR 531 N -3.95 0.89 -0.03 3.63 -4.23 -0.86 -0.84 115.64 110.24 3k5t s THR 531 Ca 0.13 -1.32 0.06 0.00 -1.18 0.00 0.00 61.69 59.38 3k5t s THR 531 Cb 0.07 -1.00 -0.01 0.00 1.34 0.00 0.00 72.50 72.90 3k5t s THR 531 CO -0.06 -0.36 -0.21 -0.76 -0.54 0.00 0.00 174.62 172.69 3k5t s LEU 532 N -1.87 2.02 0.15 4.79 1.43 -0.87 -1.10 118.68 123.24 3k5t s LEU 532 Ca -0.03 -0.41 0.04 0.00 -1.03 0.00 0.00 54.13 52.70 3k5t s LEU 532 Cb -0.08 -1.14 -0.04 0.00 0.03 0.00 0.00 46.19 44.95 3k5t s LEU 532 CO 0.01 0.24 -0.08 -1.10 0.23 0.00 0.00 176.35 175.65 3k5t s GLN 533 N -0.32 1.07 -0.15 1.70 -1.52 -0.18 -3.24 119.66 117.01 3k5t s GLN 533 Ca 0.03 -1.47 -0.18 0.00 -1.95 0.00 0.00 55.36 51.79 3k5t s GLN 533 Cb -0.10 -0.54 -0.04 0.00 -0.22 0.00 0.00 33.01 32.11 3k5t s GLN 533 CO 0.01 0.03 0.47 1.41 -0.25 0.00 0.00 175.29 176.96 3k5t s MET 534 N -3.79 4.28 -0.09 2.91 1.75 -1.26 -0.62 119.30 122.48 3k5t s MET 534 Ca 0.18 0.40 0.01 0.00 -1.25 0.00 0.00 55.69 55.03 3k5t s MET 534 Cb 0.04 -3.48 0.02 0.00 2.84 0.00 0.00 34.83 34.24 3k5t s MET 534 CO 0.01 0.06 -0.11 -1.59 -0.65 0.00 0.00 175.02 172.74 3k5t s LYS 535 N 0.96 1.77 0.63 4.11 -2.85 -0.73 -4.94 119.74 118.68 3k5t s LYS 535 Ca 0.24 -0.39 -0.17 0.00 -1.00 0.00 0.00 55.97 54.65 3k5t s LYS 535 Cb -0.15 -1.59 -0.02 0.00 -2.06 0.00 0.00 37.83 34.01 3k5t s LYS 535 CO 0.10 -0.11 1.18 -0.51 0.10 0.00 0.00 175.35 176.11 3k5t s LEU 536 N 1.13 3.55 0.12 2.77 1.43 -1.26 -2.09 118.68 124.33 3k5t s LEU 536 Ca -0.05 2.28 0.10 0.00 -1.03 0.00 0.00 54.13 55.42 3k5t s LEU 536 Cb -0.14 -4.59 -0.04 0.00 0.03 0.00 0.00 46.19 41.45 3k5t s LEU 536 CO -0.02 -1.70 -0.23 -1.83 0.23 0.00 0.00 176.35 172.79 3k5t s GLU 537 N -3.59 1.27 -0.28 1.70 -1.05 -0.03 -4.89 118.70 111.83 3k5t s GLU 537 Ca 0.74 -1.28 -0.01 0.00 -0.15 0.00 0.00 54.97 54.27 3k5t s GLU 537 Cb -0.27 -1.62 0.05 0.00 -0.44 0.00 0.00 34.13 31.85 3k5t s GLU 537 CO 0.36 0.37 -0.04 1.21 0.95 0.00 0.00 175.26 178.12 3k5t s ASN 538 N -2.08 4.68 0.15 0.83 3.84 -1.26 -2.29 114.94 118.80 3k5t s ASN 538 Ca 0.11 -1.23 0.03 0.00 0.21 0.00 0.00 52.86 51.98 3k5t s ASN 538 Cb -0.10 -1.66 -0.05 0.00 -0.55 0.00 0.00 41.25 38.90 3k5t s ASN 538 CO 0.06 -0.22 -0.05 0.27 -2.79 0.00 0.00 177.10 174.36 3k5t s ILE 539 N 1.23 0.91 0.24 -5.21 -4.36 -0.51 -4.98 121.20 108.52 3k5t s ILE 539 Ca -0.05 -2.01 -0.30 0.00 -0.26 0.00 0.00 60.65 58.03 3k5t s ILE 539 Cb -0.19 -1.94 -0.09 0.00 1.25 0.00 0.00 42.46 41.49 3k5t s ILE 539 CO -0.03 -0.66 1.29 -0.89 0.24 0.00 0.00 174.94 174.89 3k5t s THR 540 N -3.50 3.11 -0.28 8.37 2.01 -1.26 0.03 115.64 124.12 3k5t s THR 540 Ca 0.19 0.98 -0.28 0.00 0.31 0.00 0.00 61.69 62.89 3k5t s THR 540 Cb 0.05 -3.63 -0.06 0.00 0.01 0.00 0.00 72.50 68.87 3k5t s THR 540 CO 0.01 0.18 2.27 -3.20 -0.69 0.00 0.00 174.62 173.19 3k5t n ASN 541 N 2.00 3.05 0.27 3.53 2.85 -0.53 -4.64 115.26 121.79 3k5t n ASN 541 Ca 0.04 0.05 0.18 0.00 -0.11 0.00 0.00 54.58 54.74 3k5t n ASN 541 Cb 0.43 -1.56 0.95 0.00 1.24 0.00 0.00 39.78 40.84 3k5t n ASN 541 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 3k5t h PRO 542 N 16.04 0.00 -0.16 1.20 0.11 -1.91 -1.49 132.00 145.79 3k5t h PRO 542 Ca -0.37 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.74 3k5t h PRO 542 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 3k5t h PRO 542 CO 1.00 0.00 0.00 -2.67 -0.21 0.00 0.00 178.00 176.12 3k5t n TRP 543 N -2.79 0.30 -2.73 0.65 4.27 -1.26 -4.81 117.44 111.07 3k5t n TRP 543 Ca -0.02 -0.63 -0.04 0.00 -3.89 0.00 0.00 57.50 52.91 3k5t n TRP 543 Cb 0.09 -0.10 0.03 0.00 -1.36 0.00 0.00 31.31 29.97 3k5t n TRP 543 CO 0.00 0.00 0.00 0.45 -2.29 0.00 0.00 177.69 175.85 3k5t n SER 544 N -0.30 -2.69 0.30 -0.67 2.88 -0.58 -5.06 113.62 107.50 3k5t n SER 544 Ca 0.10 -2.34 0.18 0.00 -1.33 0.00 0.00 58.87 55.47 3k5t n SER 544 Cb 0.47 1.41 0.91 0.00 -0.75 0.00 0.00 64.21 66.25 3k5t n SER 544 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 3k5t h PRO 545 N 4.52 0.00 -0.53 -1.46 0.11 -1.83 0.29 132.00 133.10 3k5t h PRO 545 Ca -0.00 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.09 3k5t h PRO 545 Cb 1.12 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.21 3k5t h PRO 545 CO 0.00 0.00 0.26 0.00 -0.21 0.00 0.00 178.00 178.06 3k5t h ARG 546 N 0.00 0.73 -6.46 1.05 3.08 -1.97 -3.44 114.38 107.37 3k5t h ARG 546 Ca 0.03 -0.08 -0.50 0.00 0.07 0.00 0.00 59.98 59.49 3k5t h ARG 546 Cb 0.52 -0.15 0.01 0.00 0.08 0.00 0.00 29.97 30.43 3k5t h ARG 546 CO -0.00 0.56 -0.16 -1.01 -1.07 0.00 0.00 179.97 178.29 3k5t s HIS 547 N -5.45 1.61 0.35 3.04 3.76 0.09 -5.01 115.29 113.68 3k5t s HIS 547 Ca -0.09 -0.72 0.07 0.00 -0.15 0.00 0.00 55.06 54.17 3k5t s HIS 547 Cb 0.17 -2.16 -0.07 0.00 1.11 0.00 0.00 32.58 31.63 3k5t s HIS 547 CO 0.77 -0.92 -0.01 1.03 -0.85 0.00 0.00 174.74 174.76 3k5t s ARG 548 N -4.54 1.76 -0.12 1.40 1.81 -1.26 -1.46 118.95 116.54 3k5t s ARG 548 Ca 0.55 -1.95 -0.01 0.00 -1.72 0.00 0.00 55.73 52.59 3k5t s ARG 548 Cb -0.05 -1.34 0.04 0.00 -0.45 0.00 0.00 34.95 33.14 3k5t s ARG 548 CO 0.34 -0.03 -0.02 0.08 -0.68 0.00 0.00 175.30 174.99 3k5t s VAL 549 N -2.91 0.67 -0.25 3.52 1.01 0.10 -4.52 120.40 118.02 3k5t s VAL 549 Ca 0.34 -0.23 -0.04 0.00 0.00 0.00 0.00 61.98 62.05 3k5t s VAL 549 Cb 0.07 -0.87 0.01 0.00 0.00 0.00 0.00 36.38 35.58 3k5t s VAL 549 CO 0.16 0.17 -0.02 -0.69 0.00 0.00 0.00 175.10 174.72 3k5t s VAL 550 N 1.83 3.37 0.12 2.92 1.01 -1.26 -1.42 120.40 126.98 3k5t s VAL 550 Ca 0.03 -0.69 -0.14 0.00 0.00 0.00 0.00 61.98 61.18 3k5t s VAL 550 Cb -0.14 -2.63 0.03 0.00 0.00 0.00 0.00 36.38 33.63 3k5t s VAL 550 CO -0.07 0.28 0.36 0.00 0.00 0.00 0.00 175.10 175.67 3k5t s GLN 551 N 1.44 1.05 0.68 2.72 -2.07 -0.97 -4.95 119.66 117.55 3k5t s GLN 551 Ca 0.03 -0.78 -0.16 0.00 -1.82 0.00 0.00 55.36 52.63 3k5t s GLN 551 Cb -0.16 0.44 0.01 0.00 -1.09 0.00 0.00 33.01 32.22 3k5t s GLN 551 CO -0.02 -0.40 1.18 -2.14 -1.32 0.00 0.00 175.29 172.59 3k5t s PRO 552 N -3.83 2.51 -0.10 9.60 0.02 -1.26 -0.85 135.00 141.10 3k5t s PRO 552 Ca 0.04 1.69 -0.12 0.00 0.02 0.00 0.00 61.00 62.63 3k5t s PRO 552 Cb 0.02 -1.89 0.03 0.00 0.02 0.00 0.00 34.50 32.69 3k5t s PRO 552 CO -0.11 -1.53 0.33 0.95 -0.33 0.00 0.00 177.00 176.30 3k5t s THR 553 N -1.96 0.01 -0.46 0.99 -4.23 -0.89 -4.80 115.64 104.31 3k5t s THR 553 Ca 0.73 -0.12 -0.25 0.00 -1.18 0.00 0.00 61.69 60.88 3k5t s THR 553 Cb -0.27 -0.50 0.03 0.00 1.34 0.00 0.00 72.50 73.09 3k5t s THR 553 CO 0.41 -0.06 0.87 -0.22 -0.54 0.00 0.00 174.62 175.08 3k5t s LEU 554 N -0.18 4.10 -0.09 4.79 2.96 -1.26 -1.78 118.68 127.22 3k5t s LEU 554 Ca -0.03 0.02 -0.10 0.00 -0.22 0.00 0.00 54.13 53.81 3k5t s LEU 554 Cb -0.03 -3.11 -0.05 0.00 0.50 0.00 0.00 46.19 43.51 3k5t s LEU 554 CO 0.01 -1.01 0.22 -0.70 -1.32 0.00 0.00 176.35 173.56 3k5t s GLU 555 N 3.59 3.64 0.16 1.98 2.12 0.21 -4.98 118.70 125.43 3k5t s GLU 555 Ca 0.34 0.02 0.11 0.00 0.36 0.00 0.00 54.97 55.81 3k5t s GLU 555 Cb -0.11 -3.22 -0.04 0.00 0.26 0.00 0.00 34.13 31.02 3k5t s GLU 555 CO 0.25 0.71 -0.25 1.14 -0.54 0.00 0.00 175.26 176.57 3k5t s GLN 556 N -0.90 1.48 -0.07 4.30 1.03 -1.26 -1.02 119.66 123.22 3k5t s GLN 556 Ca 0.17 -1.44 0.01 0.00 0.04 0.00 0.00 55.36 54.15 3k5t s GLN 556 Cb -0.13 -1.88 0.02 0.00 0.03 0.00 0.00 33.01 31.05 3k5t s GLN 556 CO 0.06 0.42 -0.09 0.99 -2.54 0.00 0.00 175.29 174.14 3k5t s THR 557 N -1.39 0.93 0.26 3.63 2.01 -0.26 -5.00 115.64 115.82 3k5t s THR 557 Ca 0.18 -0.33 -0.06 0.00 0.31 0.00 0.00 61.69 61.78 3k5t s THR 557 Cb -0.09 -0.89 -0.06 0.00 0.01 0.00 0.00 72.50 71.47 3k5t s THR 557 CO 0.08 0.32 0.54 -1.10 -0.69 0.00 0.00 174.62 173.77 3k5t s GLN 558 N 0.95 3.68 -0.08 4.92 -1.52 -1.26 -2.03 119.66 124.33 3k5t s GLN 558 Ca -0.10 0.08 0.02 0.00 -1.95 0.00 0.00 55.36 53.42 3k5t s GLN 558 Cb -0.15 -2.66 0.01 0.00 -0.22 0.00 0.00 33.01 29.99 3k5t s GLN 558 CO 0.00 0.26 -0.14 0.71 -0.25 0.00 0.00 175.29 175.88 3k5t s TYR 559 N -1.97 1.63 -0.08 0.91 1.51 -1.20 -4.98 117.35 113.18 3k5t s TYR 559 Ca 0.45 -0.65 0.07 0.00 -1.01 0.00 0.00 57.07 55.92 3k5t s TYR 559 Cb -0.11 -1.19 -0.09 0.00 -0.11 0.00 0.00 41.96 40.46 3k5t s TYR 559 CO 0.27 -0.33 0.02 0.43 -1.11 0.00 0.00 175.55 174.83 3k5t n SER 560 N 3.90 3.14 -4.38 2.29 7.64 -1.26 -4.57 113.62 120.39 3k5t n SER 560 Ca -0.21 -0.00 -0.29 0.00 1.01 0.00 0.00 58.87 59.38 3k5t n SER 560 Cb 0.52 0.66 -0.13 0.00 -1.01 0.00 0.00 64.21 64.24 3k5t n SER 560 CO 0.00 0.00 0.00 0.26 -3.01 0.00 0.00 175.04 172.29 3k5t s TRP 561 N -2.18 2.26 0.17 1.43 0.52 -1.26 0.35 118.94 120.22 3k5t s TRP 561 Ca -0.04 -0.39 -0.24 0.00 0.02 0.00 0.00 56.10 55.46 3k5t s TRP 561 Cb 0.02 -1.24 0.06 0.00 -1.15 0.00 0.00 33.47 31.16 3k5t s TRP 561 CO 0.31 0.31 1.59 0.93 0.02 0.00 0.00 176.95 180.10 3k5t h GLU 562 N 3.98 -0.24 -0.66 4.98 5.08 -1.03 -1.52 114.58 125.17 3k5t h GLU 562 Ca -0.50 0.02 0.19 0.00 -1.00 0.00 0.00 59.36 58.07 3k5t h GLU 562 Cb 1.17 0.06 -0.03 0.00 0.50 0.00 0.00 28.75 30.45 3k5t h GLU 562 CO 0.39 -0.16 0.51 -0.09 -1.00 0.00 0.00 179.01 178.66 3k5t h ARG 563 N -0.25 0.00 0.00 2.33 9.65 -1.85 0.31 114.38 124.56 3k5t h ARG 563 Ca 0.18 0.00 -0.04 0.00 -1.10 0.00 0.00 59.98 59.01 3k5t h ARG 563 Cb 0.56 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.13 3k5t h ARG 563 CO -0.59 0.00 -0.21 1.96 2.80 0.00 0.00 179.97 183.93 3k5t h GLN 564 N 0.00 0.00 -0.43 0.20 4.20 -1.68 -3.04 115.11 114.36 3k5t h GLN 564 Ca 0.31 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 59.00 3k5t h GLN 564 Cb 1.33 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.09 3k5t h GLN 564 CO -0.00 0.21 0.02 0.00 -0.67 0.00 0.00 178.83 178.39 3k5t n ALA 565 N -2.43 3.52 -3.37 3.87 0.00 0.11 -4.77 120.51 117.44 3k5t n ALA 565 Ca -0.02 -2.19 -0.45 0.00 0.00 0.00 0.00 53.44 50.78 3k5t n ALA 565 Cb 0.28 -0.92 -0.05 0.00 0.00 0.00 0.00 19.45 18.76 3k5t n ALA 565 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3k5t s ALA 566 N -2.84 3.64 -0.42 0.00 0.00 -1.13 -2.43 121.76 118.57 3k5t s ALA 566 Ca 0.48 -2.62 -0.20 0.00 0.00 0.00 0.00 51.96 49.62 3k5t s ALA 566 Cb 0.38 -3.20 0.02 0.00 0.00 0.00 0.00 23.12 20.33 3k5t s ALA 566 CO 0.12 -2.02 0.61 -0.06 0.00 0.00 0.00 175.76 174.41 3k5t s PHE 567 N 1.40 3.09 0.82 0.00 0.08 -0.61 -5.02 117.98 117.74 3k5t s PHE 567 Ca 0.05 -0.04 -0.12 0.00 0.12 0.00 0.00 56.93 56.94 3k5t s PHE 567 Cb -0.27 -3.26 0.08 0.00 -0.57 0.00 0.00 43.02 39.00 3k5t s PHE 567 CO 0.01 -0.81 1.11 -0.98 -0.10 0.00 0.00 175.22 174.45 3k5t s ARG 568 N 2.71 1.93 0.53 0.44 1.70 -1.26 -2.93 118.95 122.07 3k5t s ARG 568 Ca 0.21 0.48 0.30 0.00 -0.47 0.00 0.00 55.73 56.26 3k5t s ARG 568 Cb -0.15 -1.91 1.42 0.00 -0.57 0.00 0.00 34.95 33.75 3k5t s ARG 568 CO 0.18 -1.69 2.03 0.74 -1.08 0.00 0.00 175.30 175.48 3k5t h PHE 569 N -1.13 0.00 0.19 5.89 -1.00 -1.88 -2.61 116.94 116.39 3k5t h PHE 569 Ca -0.48 0.00 -0.32 0.00 2.81 0.00 0.00 57.97 59.99 3k5t h PHE 569 Cb 1.29 0.00 0.02 0.00 3.61 0.00 0.00 35.95 40.87 3k5t h PHE 569 CO 0.41 0.11 -1.44 0.87 -1.61 0.00 0.00 178.31 176.65 3k5t h LYS 570 N 0.00 0.41 -6.01 1.51 1.57 -1.93 -3.44 116.57 108.68 3k5t h LYS 570 Ca -0.00 -0.70 -0.59 0.00 -1.87 0.00 0.00 60.65 57.50 3k5t h LYS 570 Cb 0.43 0.26 0.00 0.00 0.08 0.00 0.00 32.23 33.00 3k5t h LYS 570 CO 0.01 1.32 1.48 0.50 -0.57 0.00 0.00 179.45 182.19 3k5t s ARG 571 N -2.62 3.18 0.15 3.15 3.52 -0.99 -4.92 118.95 120.43 3k5t s ARG 571 Ca -0.08 2.06 -0.34 0.00 -0.13 0.00 0.00 55.73 57.24 3k5t s ARG 571 Cb 0.05 -4.36 -0.14 0.00 -1.56 0.00 0.00 34.95 28.94 3k5t s ARG 571 CO 0.91 -2.05 1.59 0.36 -0.81 0.00 0.00 175.30 175.30 3k5t n LYS 572 N 8.69 2.15 -2.74 5.12 -0.00 -1.26 -4.65 118.16 125.48 3k5t n LYS 572 Ca 0.29 0.78 -0.42 0.00 -0.00 0.00 0.00 58.31 58.96 3k5t n LYS 572 Cb 0.45 -2.55 -0.03 0.00 -0.00 0.00 0.00 35.03 32.90 3k5t n LYS 572 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.40 176.23 3k5t s LEU 573 N 1.03 4.25 0.49 -5.58 2.96 -1.26 -5.01 118.68 115.56 3k5t s LEU 573 Ca 0.79 1.47 -0.24 0.00 -0.22 0.00 0.00 54.13 55.94 3k5t s LEU 573 Cb -0.68 -3.49 -0.07 0.00 0.50 0.00 0.00 46.19 42.46 3k5t s LEU 573 CO 0.38 -0.40 1.39 -2.84 -1.32 0.00 0.00 176.35 173.56 3k5t s PRO 574 N 1.86 3.46 0.52 0.98 0.02 -1.26 -4.90 135.00 135.68 3k5t s PRO 574 Ca 0.47 2.32 0.21 0.00 0.02 0.00 0.00 61.00 64.02 3k5t s PRO 574 Cb -0.18 -2.49 1.37 0.00 0.02 0.00 0.00 34.50 33.22 3k5t s PRO 574 CO 0.18 -0.96 2.13 0.87 -0.33 0.00 0.00 177.00 178.89 3k5t h LYS 575 N 1.96 0.00 -4.71 5.54 6.56 -1.96 -3.40 116.57 120.57 3k5t h LYS 575 Ca -0.51 0.00 -0.62 0.00 -1.06 0.00 0.00 60.65 58.46 3k5t h LYS 575 Cb 1.28 0.00 -0.36 0.00 -0.57 0.00 0.00 32.23 32.58 3k5t h LYS 575 CO 0.59 0.06 -0.83 0.71 -2.06 0.00 0.00 179.45 177.93 3k5t s TYR 576 N -4.73 2.39 -0.29 -1.35 1.51 -1.20 -5.03 117.35 108.65 3k5t s TYR 576 Ca -0.04 -1.45 -0.01 0.00 -1.01 0.00 0.00 57.07 54.56 3k5t s TYR 576 Cb 0.16 -1.67 0.06 0.00 -0.11 0.00 0.00 41.96 40.39 3k5t s TYR 576 CO 0.63 -0.72 -0.02 -0.51 -1.11 0.00 0.00 175.55 173.82 3k5t s LEU 577 N 1.41 3.85 -0.07 -1.29 1.43 -1.26 -2.04 118.68 120.71 3k5t s LEU 577 Ca 0.03 -1.35 0.05 0.00 -1.03 0.00 0.00 54.13 51.83 3k5t s LEU 577 Cb -0.14 -1.67 -0.01 0.00 0.03 0.00 0.00 46.19 44.39 3k5t s LEU 577 CO -0.10 -0.25 -0.22 -0.76 0.23 0.00 0.00 176.35 175.24 3k5t s LEU 578 N 1.20 2.21 -0.28 1.79 1.43 -0.02 -0.40 118.68 124.61 3k5t s LEU 578 Ca -0.05 -0.47 -0.04 0.00 -1.03 0.00 0.00 54.13 52.53 3k5t s LEU 578 Cb -0.20 -1.43 0.02 0.00 0.03 0.00 0.00 46.19 44.62 3k5t s LEU 578 CO -0.02 0.23 0.02 -0.36 0.23 0.00 0.00 176.35 176.45 3k5t s PHE 579 N -0.06 3.15 0.09 0.29 0.40 -0.11 -1.23 117.98 120.51 3k5t s PHE 579 Ca -0.06 -1.34 0.04 0.00 -0.60 0.00 0.00 56.93 54.97 3k5t s PHE 579 Cb -0.14 -2.17 -0.04 0.00 0.51 0.00 0.00 43.02 41.17 3k5t s PHE 579 CO 0.05 -0.68 0.06 0.95 0.70 0.00 0.00 175.22 176.30 3k5t s THR 580 N 1.40 4.38 0.12 0.64 -4.23 0.14 -2.00 115.64 116.09 3k5t s THR 580 Ca 0.00 -0.85 -0.04 0.00 -1.18 0.00 0.00 61.69 59.62 3k5t s THR 580 Cb -0.18 -3.11 -0.05 0.00 1.34 0.00 0.00 72.50 70.50 3k5t s THR 580 CO -0.00 0.11 0.34 -0.55 -0.54 0.00 0.00 174.62 173.98 3k5t s SER 581 N -2.41 6.47 0.40 3.99 0.15 0.17 -1.64 113.70 120.82 3k5t s SER 581 Ca 0.28 0.53 0.06 0.00 0.70 0.00 0.00 55.95 57.52 3k5t s SER 581 Cb -0.12 -2.07 0.83 0.00 -1.71 0.00 0.00 66.02 62.95 3k5t s SER 581 CO 0.21 0.08 2.05 -0.65 1.20 0.00 0.00 173.24 176.13 3k5t h PRO 582 N 2.90 0.58 -6.84 5.44 0.11 -1.85 -3.32 132.00 129.02 3k5t h PRO 582 Ca -0.46 -0.04 -0.57 0.00 0.11 0.00 0.00 66.00 65.05 3k5t h PRO 582 Cb 1.16 -0.13 0.14 0.00 0.11 0.00 0.00 31.00 32.29 3k5t h PRO 582 CO 0.73 0.39 0.31 1.04 -0.21 0.00 0.00 178.00 180.26 3k5t n GLN 583 N -4.47 1.36 -4.14 1.05 6.02 -1.26 -4.84 117.38 111.09 3k5t n GLN 583 Ca 0.04 0.50 -0.25 0.00 -0.01 0.00 0.00 57.00 57.28 3k5t n GLN 583 Cb 0.06 -2.28 -0.06 0.00 1.02 0.00 0.00 30.24 28.98 3k5t n GLN 583 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 3k5t s GLU 584 N -2.54 2.75 0.42 -1.09 2.02 -1.26 -1.71 118.70 117.29 3k5t s GLU 584 Ca 0.70 -1.03 -0.04 0.00 0.02 0.00 0.00 54.97 54.62 3k5t s GLU 584 Cb -0.46 -2.51 0.09 0.00 0.10 0.00 0.00 34.13 31.34 3k5t s GLU 584 CO 0.51 0.44 0.57 0.27 0.02 0.00 0.00 175.26 177.07 3k5t n ASN 585 N -0.59 0.34 0.00 -0.19 6.94 0.72 -4.83 115.26 117.65 3k5t n ASN 585 Ca -0.08 -1.39 0.07 0.00 -0.02 0.00 0.00 54.58 53.16 3k5t n ASN 585 Cb 0.56 -0.41 0.34 0.00 -2.36 0.00 0.00 39.78 37.91 3k5t n ASN 585 CO 0.00 0.00 0.00 -2.65 -1.03 0.00 0.00 177.26 173.58 3k5t n PRO 586 N -2.14 0.14 -0.19 -0.53 -0.02 -1.26 -2.66 135.00 128.34 3k5t n PRO 586 Ca 0.08 0.19 0.05 0.00 -2.02 0.00 0.00 63.50 61.80 3k5t n PRO 586 Cb 0.28 -1.50 0.15 0.00 -0.02 0.00 0.00 33.50 32.41 3k5t n PRO 586 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 3k5t n TRP 587 N -1.35 0.46 -0.12 6.00 5.03 -1.26 -4.98 117.44 121.22 3k5t n TRP 587 Ca 0.06 -0.58 0.00 0.00 3.03 0.00 0.00 57.50 60.01 3k5t n TRP 587 Cb 0.13 -0.08 0.00 0.00 -1.03 0.00 0.00 31.31 30.33 3k5t n TRP 587 CO 0.00 0.00 0.00 0.41 -0.03 0.00 0.00 177.69 178.07 3k5t n GLY 588 N 0.15 0.69 3.91 6.99 0.00 -1.09 -5.06 105.19 110.78 3k5t n GLY 588 Ca 0.12 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 3k5t n GLY 588 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3k5t s HIS 589 N -2.37 3.49 0.25 1.61 3.76 -1.26 -4.74 115.29 116.02 3k5t s HIS 589 Ca 0.00 0.44 -0.30 0.00 -0.15 0.00 0.00 55.06 55.05 3k5t s HIS 589 Cb 0.00 -1.92 -0.10 0.00 1.11 0.00 0.00 32.58 31.67 3k5t s HIS 589 CO 0.00 0.48 1.43 -1.59 -0.85 0.00 0.00 174.74 174.21 3k5t s LYS 590 N -2.67 4.27 -0.03 1.40 0.00 -1.26 -0.20 119.74 121.25 3k5t s LYS 590 Ca 0.39 2.29 -0.30 0.00 0.00 0.00 0.00 55.97 58.35 3k5t s LYS 590 Cb -0.12 -3.11 -0.04 0.00 0.00 0.00 0.00 37.83 34.56 3k5t s LYS 590 CO 0.26 -0.41 1.15 1.03 0.00 0.00 0.00 175.35 177.38 3k5t s ARG 591 N -0.41 4.40 0.13 1.78 0.52 -0.69 -4.62 118.95 120.06 3k5t s ARG 591 Ca 0.59 1.64 -0.13 0.00 -0.52 0.00 0.00 55.73 57.31 3k5t s ARG 591 Cb -0.42 -3.50 0.01 0.00 0.52 0.00 0.00 34.95 31.57 3k5t s ARG 591 CO 0.43 -0.35 0.33 -1.54 0.02 0.00 0.00 175.30 174.20 3k5t s SER 592 N 1.30 -0.08 -0.09 0.23 1.04 -0.34 0.42 113.70 116.18 3k5t s SER 592 Ca 0.55 -0.56 0.03 0.00 0.48 0.00 0.00 55.95 56.45 3k5t s SER 592 Cb -0.25 0.44 -0.01 0.00 0.10 0.00 0.00 66.02 66.30 3k5t s SER 592 CO 0.24 -0.86 -0.19 -0.31 0.98 0.00 0.00 173.24 173.10 3k5t s TYR 593 N -3.87 2.63 -0.11 5.02 1.51 -0.85 0.78 117.35 122.47 3k5t s TYR 593 Ca 0.08 -0.62 -0.12 0.00 -1.01 0.00 0.00 57.07 55.40 3k5t s TYR 593 Cb 0.03 -1.70 -0.05 0.00 -0.11 0.00 0.00 41.96 40.13 3k5t s TYR 593 CO -0.08 -0.16 0.26 0.50 -1.11 0.00 0.00 175.55 174.97 3k5t s ARG 594 N -0.05 3.91 -0.22 -0.62 3.52 0.24 -0.93 118.95 124.79 3k5t s ARG 594 Ca -0.05 0.07 -0.08 0.00 -0.13 0.00 0.00 55.73 55.54 3k5t s ARG 594 Cb -0.14 -3.30 -0.04 0.00 -1.56 0.00 0.00 34.95 29.91 3k5t s ARG 594 CO 0.04 0.53 0.09 -1.17 -0.81 0.00 0.00 175.30 173.99 3k5t s LEU 595 N -0.41 3.74 -0.23 -0.88 2.96 0.47 -1.20 118.68 123.14 3k5t s LEU 595 Ca 0.17 -0.03 0.01 0.00 -0.22 0.00 0.00 54.13 54.06 3k5t s LEU 595 Cb -0.13 -1.99 0.06 0.00 0.50 0.00 0.00 46.19 44.63 3k5t s LEU 595 CO 0.06 0.06 -0.07 -1.58 -1.32 0.00 0.00 176.35 173.50 3k5t s GLN 596 N 1.05 1.76 -0.07 1.98 0.74 -0.09 -4.13 119.66 120.91 3k5t s GLN 596 Ca 0.05 -0.99 -0.19 0.00 0.05 0.00 0.00 55.36 54.29 3k5t s GLN 596 Cb -0.14 -2.57 -0.05 0.00 1.10 0.00 0.00 33.01 31.35 3k5t s GLN 596 CO 0.03 -0.56 0.52 0.42 -0.55 0.00 0.00 175.29 175.16 3k5t s ILE 597 N 1.37 5.08 -0.37 -2.34 1.01 -1.26 -0.58 121.20 124.10 3k5t s ILE 597 Ca -0.05 1.06 -0.07 0.00 0.00 0.00 0.00 60.65 61.59 3k5t s ILE 597 Cb -0.18 -3.85 0.06 0.00 0.01 0.00 0.00 42.46 38.49 3k5t s ILE 597 CO -0.06 0.38 0.17 -1.00 0.00 0.00 0.00 174.94 174.42 3k5t s HIS 598 N 0.19 3.32 0.20 3.97 3.76 0.19 -4.96 115.29 121.96 3k5t s HIS 598 Ca 0.28 -1.55 -0.23 0.00 -0.15 0.00 0.00 55.06 53.41 3k5t s HIS 598 Cb -0.16 -2.60 0.05 0.00 1.11 0.00 0.00 32.58 30.98 3k5t s HIS 598 CO 0.13 -0.79 0.72 0.45 -0.85 0.00 0.00 174.74 174.40 3k5t s SER 599 N 1.69 -0.36 -0.09 1.40 0.15 -1.26 -1.07 113.70 114.16 3k5t s SER 599 Ca 0.01 -0.33 0.13 0.00 0.70 0.00 0.00 55.95 56.46 3k5t s SER 599 Cb -0.21 0.63 0.21 0.00 -1.71 0.00 0.00 66.02 64.94 3k5t s SER 599 CO 0.02 -1.10 1.11 0.23 1.20 0.00 0.00 173.24 174.69 3k5t n MET 600 N -0.42 0.86 -2.27 5.44 2.81 0.81 -4.94 117.12 119.40 3k5t n MET 600 Ca -0.09 -2.11 -0.35 0.00 -1.81 0.00 0.00 57.70 53.34 3k5t n MET 600 Cb 0.61 -1.14 -0.00 0.00 -0.71 0.00 0.00 33.22 31.98 3k5t n MET 600 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3k5t s ALA 601 N -1.90 2.71 0.24 3.04 0.00 -0.82 -4.48 121.76 120.54 3k5t s ALA 601 Ca 0.22 0.76 0.05 0.00 0.00 0.00 0.00 51.96 52.99 3k5t s ALA 601 Cb 0.20 -3.33 -0.02 0.00 0.00 0.00 0.00 23.12 19.97 3k5t s ALA 601 CO 0.01 -0.72 0.18 -3.47 0.00 0.00 0.00 175.76 171.76 3k5t n ASP 602 N -1.33 -0.24 -4.74 0.00 -0.08 -1.26 -4.98 116.55 103.91 3k5t n ASP 602 Ca 0.11 -2.54 -0.41 0.00 -1.51 0.00 0.00 54.79 50.44 3k5t n ASP 602 Cb 0.51 1.11 -0.03 0.00 2.34 0.00 0.00 41.12 45.05 3k5t n ASP 602 CO 0.00 0.00 0.00 -1.58 0.12 0.00 0.00 177.20 175.74 3k5t s GLN 603 N -2.98 4.41 -0.00 -0.67 2.00 -1.26 -4.96 119.66 116.20 3k5t s GLN 603 Ca 0.26 2.04 -0.02 0.00 -2.00 0.00 0.00 55.36 55.64 3k5t s GLN 603 Cb 0.01 -3.18 -0.01 0.00 0.80 0.00 0.00 33.01 30.64 3k5t s GLN 603 CO 0.18 -0.20 -0.04 0.28 -0.50 0.00 0.00 175.29 175.02 3k5t n VAL 604 N 2.27 0.36 -2.92 1.34 0.31 -1.26 -5.01 118.33 113.42 3k5t n VAL 604 Ca 0.05 0.23 -0.36 0.00 -0.01 0.00 0.00 64.34 64.25 3k5t n VAL 604 Cb 0.43 -1.39 -0.06 0.00 -0.91 0.00 0.00 33.84 31.90 3k5t n VAL 604 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 3k5t s LEU 605 N -5.64 4.30 0.14 7.52 1.43 -1.26 -5.03 118.68 120.14 3k5t s LEU 605 Ca -0.03 1.64 -0.32 0.00 -1.03 0.00 0.00 54.13 54.39 3k5t s LEU 605 Cb 0.00 -3.89 -0.11 0.00 0.03 0.00 0.00 46.19 42.22 3k5t s LEU 605 CO 0.05 -0.06 1.80 -2.65 0.23 0.00 0.00 176.35 175.72 3k5t n PRO 606 N 0.49 2.75 -1.65 1.29 -0.02 -1.26 -4.92 135.00 131.69 3k5t n PRO 606 Ca 0.01 1.00 -0.50 0.00 -2.02 0.00 0.00 63.50 61.99 3k5t n PRO 606 Cb 0.51 -2.88 -0.05 0.00 -0.02 0.00 0.00 33.50 31.06 3k5t n PRO 606 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 3k5t n PRO 607 N 5.15 1.69 0.00 0.52 -0.02 -1.26 -1.76 135.00 139.31 3k5t n PRO 607 Ca 0.18 0.61 0.00 0.00 -2.02 0.00 0.00 63.50 62.27 3k5t n PRO 607 Cb 0.36 -2.34 0.00 0.00 -0.02 0.00 0.00 33.50 31.50 3k5t n PRO 607 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3k5t n GLY 608 N 3.35 3.08 3.55 -1.23 0.00 -1.26 -5.01 105.19 107.66 3k5t n GLY 608 Ca 0.19 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.81 3k5t n GLY 608 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 3k5t s TRP 609 N -2.95 2.12 0.00 1.61 -0.11 -0.72 -4.81 118.94 114.09 3k5t s TRP 609 Ca 0.00 0.14 0.00 0.00 1.22 0.00 0.00 56.10 57.46 3k5t s TRP 609 Cb 0.00 -4.48 0.00 0.00 -1.50 0.00 0.00 33.47 27.49 3k5t s TRP 609 CO 0.00 -2.13 0.00 1.04 -4.62 0.00 0.00 176.95 171.24 3k5t n GLN 610 N 9.30 0.00 0.11 5.86 1.13 -1.26 -1.93 117.38 130.58 3k5t n GLN 610 Ca 0.09 0.00 0.12 0.00 -1.94 0.00 0.00 57.00 55.27 3k5t n GLN 610 Cb 0.50 0.00 0.46 0.00 0.11 0.00 0.00 30.24 31.31 3k5t n GLN 610 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 3k5t n GLU 611 N 0.00 0.19 0.31 -1.09 4.71 -1.26 -1.85 120.64 121.65 3k5t n GLU 611 Ca 0.00 0.33 0.18 0.00 -0.01 0.00 0.00 57.16 57.65 3k5t n GLU 611 Cb 0.00 -1.81 1.00 0.00 -1.01 0.00 0.00 31.44 29.63 3k5t n GLU 611 CO 0.00 0.00 0.00 1.49 0.09 0.00 0.00 177.13 178.71 3k5t h GLU 612 N 0.00 0.00 -0.05 3.49 4.22 -1.63 -2.29 114.58 118.32 3k5t h GLU 612 Ca 0.00 0.00 0.02 0.00 0.08 0.00 0.00 59.36 59.46 3k5t h GLU 612 Cb 0.48 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.73 3k5t h GLU 612 CO 0.00 0.01 0.18 0.37 -2.18 0.00 0.00 179.01 177.40 3k5t h GLN 613 N 0.00 0.00 0.00 1.92 5.75 -1.50 -0.60 115.11 120.68 3k5t h GLN 613 Ca -0.00 0.00 -0.06 0.00 -0.15 0.00 0.00 58.65 58.44 3k5t h GLN 613 Cb 0.06 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.60 3k5t h GLN 613 CO 0.00 0.00 -0.55 0.00 -2.65 0.00 0.00 178.83 175.63 3k5t h ALA 614 N 1.69 0.75 -1.23 3.38 0.00 -0.89 -3.39 119.26 119.57 3k5t h ALA 614 Ca 0.03 -0.26 -0.47 0.00 0.00 0.00 0.00 54.91 54.20 3k5t h ALA 614 Cb 0.39 0.01 -0.41 0.00 0.00 0.00 0.00 17.79 17.78 3k5t h ALA 614 CO -0.00 0.33 -0.96 0.44 0.00 0.00 0.00 179.25 179.05 3k5t n ILE 615 N -3.03 1.69 0.69 0.00 -5.35 -0.24 -4.83 119.36 108.29 3k5t n ILE 615 Ca 0.01 -3.98 0.10 0.00 -0.27 0.00 0.00 62.75 58.61 3k5t n ILE 615 Cb 0.64 -0.28 0.45 0.00 -1.74 0.00 0.00 39.64 38.70 3k5t n ILE 615 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 3k5t n THR 616 N -0.29 0.59 0.25 7.28 -2.24 -1.15 -1.63 114.28 117.08 3k5t n THR 616 Ca 0.24 0.12 0.12 0.00 -2.27 0.00 0.00 64.05 62.26 3k5t n THR 616 Cb 0.75 -0.80 0.67 0.00 -2.10 0.00 0.00 70.33 68.85 3k5t n THR 616 CO 0.00 0.00 0.00 4.11 -0.57 0.00 0.00 175.07 178.61 3k5t h TRP 617 N 0.00 0.00 0.00 4.78 5.08 -1.90 -3.04 115.95 120.87 3k5t h TRP 617 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 3k5t h TRP 617 Cb 0.38 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.54 3k5t h TRP 617 CO 0.00 0.14 0.00 0.00 -1.28 0.00 0.00 178.44 177.30 3k5t n ALA 618 N -2.29 2.30 0.22 0.11 0.00 -0.65 -1.86 120.51 118.34 3k5t n ALA 618 Ca -0.02 -0.13 0.11 0.00 0.00 0.00 0.00 53.44 53.40 3k5t n ALA 618 Cb 0.26 -1.39 0.31 0.00 0.00 0.00 0.00 19.45 18.63 3k5t n ALA 618 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3k5t h ARG 619 N 0.00 0.00 -4.70 0.00 3.08 -1.71 -3.43 114.38 107.62 3k5t h ARG 619 Ca 0.00 0.00 -0.65 0.00 0.07 0.00 0.00 59.98 59.40 3k5t h ARG 619 Cb 0.12 0.00 -0.38 0.00 0.08 0.00 0.00 29.97 29.79 3k5t h ARG 619 CO 0.00 0.13 -0.78 0.71 -1.07 0.00 0.00 179.97 178.96 3k5t s TYR 620 N -3.35 3.13 0.41 3.04 2.02 -0.78 -2.70 117.35 119.13 3k5t s TYR 620 Ca 0.04 -2.31 0.08 0.00 -0.37 0.00 0.00 57.07 54.51 3k5t s TYR 620 Cb 0.07 -2.02 0.89 0.00 -0.40 0.00 0.00 41.96 40.50 3k5t s TYR 620 CO 0.65 -0.87 2.04 -1.00 -1.57 0.00 0.00 175.55 174.80 3k5t h PRO 621 N 7.79 0.52 -4.35 -1.71 0.13 -1.79 -3.31 132.00 129.28 3k5t h PRO 621 Ca -0.16 -0.03 -0.36 0.00 -0.87 0.00 0.00 66.00 64.57 3k5t h PRO 621 Cb 1.04 -0.12 -0.30 0.00 0.13 0.00 0.00 31.00 31.76 3k5t h PRO 621 CO 0.46 0.34 -0.77 -1.17 -0.23 0.00 0.00 178.00 176.64 3k5t s LEU 622 N -9.47 1.83 -0.01 1.56 2.96 -1.26 -2.42 118.68 111.88 3k5t s LEU 622 Ca -0.08 -0.12 0.00 0.00 -0.22 0.00 0.00 54.13 53.71 3k5t s LEU 622 Cb 0.18 -0.36 0.01 0.00 0.50 0.00 0.00 46.19 46.51 3k5t s LEU 622 CO 0.73 0.05 0.01 0.00 -1.32 0.00 0.00 176.35 175.82 3k5t s ALA 623 N 0.12 0.07 -0.22 5.97 0.00 0.07 -1.57 121.76 126.20 3k5t s ALA 623 Ca -0.01 0.09 -0.05 0.00 0.00 0.00 0.00 51.96 51.99 3k5t s ALA 623 Cb -0.06 -0.10 -0.01 0.00 0.00 0.00 0.00 23.12 22.95 3k5t s ALA 623 CO -0.00 -0.03 -0.02 0.08 0.00 0.00 0.00 175.76 175.79 3k5t s VAL 624 N 0.38 3.60 0.30 0.00 1.01 -1.02 0.32 120.40 124.99 3k5t s VAL 624 Ca -0.03 -0.42 0.09 0.00 0.00 0.00 0.00 61.98 61.63 3k5t s VAL 624 Cb -0.05 -2.65 -0.05 0.00 0.00 0.00 0.00 36.38 33.64 3k5t s VAL 624 CO -0.01 0.41 -0.00 0.42 0.00 0.00 0.00 175.10 175.91 3k5t s THR 625 N 1.47 3.06 0.04 3.92 -4.23 0.47 -4.76 115.64 115.60 3k5t s THR 625 Ca 0.05 -1.96 -0.25 0.00 -1.18 0.00 0.00 61.69 58.36 3k5t s THR 625 Cb -0.14 -2.79 -0.05 0.00 1.34 0.00 0.00 72.50 70.85 3k5t s THR 625 CO -0.01 -0.30 0.77 -0.75 -0.54 0.00 0.00 174.62 173.78 3k5t s LYS 626 N -3.69 4.50 0.44 3.99 2.20 -1.26 0.25 119.74 126.16 3k5t s LYS 626 Ca 0.33 1.07 -0.26 0.00 -0.36 0.00 0.00 55.97 56.75 3k5t s LYS 626 Cb -0.04 -3.37 -0.09 0.00 -1.51 0.00 0.00 37.83 32.82 3k5t s LYS 626 CO 0.20 0.26 1.45 0.98 -0.36 0.00 0.00 175.35 177.87 3k5t n TYR 627 N 2.89 2.77 -3.59 4.03 4.19 0.15 -4.86 117.16 122.75 3k5t n TYR 627 Ca -0.02 0.44 -0.16 0.00 3.31 0.00 0.00 57.90 61.47 3k5t n TYR 627 Cb 0.50 -2.47 -0.07 0.00 0.49 0.00 0.00 39.34 37.79 3k5t n TYR 627 CO 0.00 0.00 0.00 1.03 0.91 0.00 0.00 176.86 178.80 3k5t s ARG 628 N -2.40 0.93 0.41 2.98 1.81 -1.26 -5.00 118.95 116.42 3k5t s ARG 628 Ca 0.60 0.70 0.29 0.00 -1.72 0.00 0.00 55.73 55.60 3k5t s ARG 628 Cb -0.45 0.45 1.40 0.00 -0.45 0.00 0.00 34.95 35.90 3k5t s ARG 628 CO 0.58 -0.19 1.88 0.93 -0.68 0.00 0.00 175.30 177.82 3k5t h GLU 629 N 4.19 0.00 -0.01 3.54 4.39 -2.03 -1.66 114.58 123.01 3k5t h GLU 629 Ca -0.28 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.42 3k5t h GLU 629 Cb 1.15 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.80 3k5t h GLU 629 CO 0.19 0.00 -0.13 -1.13 -1.16 0.00 0.00 179.01 176.78 3k5t n SER 630 N -2.57 0.84 -2.57 1.42 3.41 -1.26 -4.26 113.62 108.63 3k5t n SER 630 Ca -0.00 -0.90 -0.10 0.00 -0.26 0.00 0.00 58.87 57.61 3k5t n SER 630 Cb 0.15 0.02 0.04 0.00 -0.26 0.00 0.00 64.21 64.16 3k5t n SER 630 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3k5t n GLU 631 N -0.62 2.28 0.15 4.33 1.02 -0.62 -4.86 120.64 122.32 3k5t n GLU 631 Ca 0.15 -3.73 0.02 0.00 -0.02 0.00 0.00 57.16 53.58 3k5t n GLU 631 Cb 0.31 -1.79 0.19 0.00 -0.02 0.00 0.00 31.44 30.13 3k5t n GLU 631 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 3k5t h LEU 632 N 2.55 0.00 -8.06 -4.62 3.38 -1.74 -3.45 115.31 103.36 3k5t h LEU 632 Ca 0.04 0.00 -0.42 0.00 0.09 0.00 0.00 57.88 57.59 3k5t h LEU 632 Cb 1.30 0.00 -0.29 0.00 0.09 0.00 0.00 40.66 41.76 3k5t h LEU 632 CO 0.43 0.53 -0.79 0.00 0.09 0.00 0.00 178.44 178.71 3k5t n SER 634 N 2.92 0.94 -1.15 0.00 3.41 -1.26 -4.94 113.62 113.54 3k5t n SER 634 Ca -0.15 -1.21 -0.01 0.00 -0.26 0.00 0.00 58.87 57.24 3k5t n SER 634 Cb 0.56 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 64.51 3k5t n SER 634 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 3k5t n SER 635 N -0.33 -0.11 -2.82 4.04 2.88 -1.26 -4.63 113.62 111.39 3k5t n SER 635 Ca 0.19 -1.14 -0.06 0.00 -1.33 0.00 0.00 58.87 56.53 3k5t n SER 635 Cb 0.28 0.20 0.02 0.00 -0.75 0.00 0.00 64.21 63.96 3k5t n SER 635 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 3k5t n SER 636 N -2.03 -1.96 0.00 -3.46 3.41 -1.26 -4.94 113.62 103.37 3k5t n SER 636 Ca 0.00 -2.27 0.13 0.00 -0.26 0.00 0.00 58.87 56.47 3k5t n SER 636 Cb 0.04 3.25 0.66 0.00 -0.26 0.00 0.00 64.21 67.90 3k5t n SER 636 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 3k5t n ILE 637 N -0.56 0.15 -0.01 -1.33 -5.35 -1.26 -3.51 119.36 107.49 3k5t n ILE 637 Ca -0.06 0.04 0.05 0.00 -0.27 0.00 0.00 62.75 62.51 3k5t n ILE 637 Cb 0.55 -0.60 -0.14 0.00 -1.74 0.00 0.00 39.64 37.71 3k5t n ILE 637 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 3k5t n TYR 638 N -1.29 0.21 -0.21 4.28 4.02 -1.26 -4.30 117.16 118.60 3k5t n TYR 638 Ca 0.12 0.07 0.11 0.00 -0.01 0.00 0.00 57.90 58.19 3k5t n TYR 638 Cb 0.21 -0.73 0.40 0.00 -0.02 0.00 0.00 39.34 39.20 3k5t n TYR 638 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 3k5t h HIS 639 N 0.00 0.72 -0.56 -0.72 3.86 -1.82 -2.09 115.15 114.55 3k5t h HIS 639 Ca -0.14 0.02 0.01 0.00 -1.16 0.00 0.00 60.37 59.10 3k5t h HIS 639 Cb 1.34 -0.23 -0.03 0.00 1.06 0.00 0.00 27.41 29.55 3k5t h HIS 639 CO 0.00 0.31 0.36 0.37 0.86 0.00 0.00 177.93 179.83 3k5t h GLN 640 N 0.65 0.70 -0.01 2.45 5.75 -1.82 -2.09 115.11 120.74 3k5t h GLN 640 Ca 0.38 -0.04 0.00 0.00 -0.15 0.00 0.00 58.65 58.84 3k5t h GLN 640 Cb 0.58 -0.16 0.00 0.00 1.07 0.00 0.00 27.48 28.98 3k5t h GLN 640 CO -0.15 0.46 -0.62 0.09 -2.65 0.00 0.00 178.83 175.97 3k5t n ASN 641 N -4.73 1.76 -3.14 -0.69 3.02 -1.00 -4.12 115.26 106.37 3k5t n ASN 641 Ca 0.04 -1.38 -0.22 0.00 -0.03 0.00 0.00 54.58 52.99 3k5t n ASN 641 Cb 0.04 0.62 -0.06 0.00 -0.61 0.00 0.00 39.78 39.78 3k5t n ASN 641 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 3k5t n ASP 642 N -0.41 -0.21 0.00 6.41 2.03 -0.82 -4.56 116.55 118.99 3k5t n ASP 642 Ca 0.08 -2.76 0.11 0.00 0.52 0.00 0.00 54.79 52.74 3k5t n ASP 642 Cb 0.43 -0.34 0.58 0.00 -0.72 0.00 0.00 41.12 41.07 3k5t n ASP 642 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 3k5t n PRO 643 N 1.45 0.31 0.10 -0.67 -0.04 -0.79 -2.77 135.00 132.59 3k5t n PRO 643 Ca 0.20 0.07 -0.22 0.00 -0.04 0.00 0.00 63.50 63.50 3k5t n PRO 643 Cb 0.54 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 32.35 3k5t n PRO 643 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 3k5t h TRP 644 N 0.00 0.77 -1.99 0.54 6.55 -1.85 -2.44 115.95 117.53 3k5t h TRP 644 Ca 0.00 -0.56 -0.51 0.00 0.95 0.00 0.00 58.89 58.76 3k5t h TRP 644 Cb 0.23 -0.03 -0.41 0.00 -0.86 0.00 0.00 29.16 28.09 3k5t h TRP 644 CO 0.00 1.44 -1.00 -3.47 -1.05 0.00 0.00 178.44 174.37 3k5t n ASP 645 N -3.92 2.26 -4.80 -3.49 2.03 -1.22 -4.82 116.55 102.59 3k5t n ASP 645 Ca -0.15 -3.24 -0.30 0.00 0.52 0.00 0.00 54.79 51.61 3k5t n ASP 645 Cb 0.97 -0.59 0.08 0.00 -0.72 0.00 0.00 41.12 40.86 3k5t n ASP 645 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 3k5t s PRO 646 N -2.88 2.28 0.00 -0.67 0.04 -1.11 -4.96 135.00 127.70 3k5t s PRO 646 Ca 0.42 0.75 0.29 0.00 0.04 0.00 0.00 61.00 62.51 3k5t s PRO 646 Cb 0.34 -1.93 1.36 0.00 0.04 0.00 0.00 34.50 34.31 3k5t s PRO 646 CO -0.10 -1.51 1.96 -0.35 0.04 0.00 0.00 177.00 177.04 3k5t n PRO 647 N -3.38 0.43 -3.76 0.56 -0.04 -1.26 -4.61 135.00 122.94 3k5t n PRO 647 Ca 0.07 -0.06 -0.19 0.00 -0.04 0.00 0.00 63.50 63.27 3k5t n PRO 647 Cb 0.55 -1.50 -0.17 0.00 -0.04 0.00 0.00 33.50 32.34 3k5t n PRO 647 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3k5t s VAL 648 N -2.62 0.06 -0.28 0.52 1.01 -1.26 -5.10 120.40 112.73 3k5t s VAL 648 Ca 0.26 0.27 -0.00 0.00 0.00 0.00 0.00 61.98 62.51 3k5t s VAL 648 Cb 0.20 -0.25 0.05 0.00 0.00 0.00 0.00 36.38 36.38 3k5t s VAL 648 CO 0.48 0.18 -0.04 -0.69 0.00 0.00 0.00 175.10 175.03 3k5t s VAL 649 N 1.77 2.74 0.43 2.92 1.01 -1.26 -4.86 120.40 123.15 3k5t s VAL 649 Ca 0.00 -1.38 0.15 0.00 0.00 0.00 0.00 61.98 60.75 3k5t s VAL 649 Cb -0.12 -2.54 0.34 0.00 0.00 0.00 0.00 36.38 34.05 3k5t s VAL 649 CO -0.03 -0.02 1.97 0.15 0.00 0.00 0.00 175.10 177.17 3k5t h PHE 650 N 7.94 0.44 -0.94 5.22 3.57 -1.88 -0.55 116.94 130.74 3k5t h PHE 650 Ca -0.23 0.01 0.15 0.00 3.53 0.00 0.00 57.97 61.43 3k5t h PHE 650 Cb 1.07 -0.14 -0.08 0.00 2.79 0.00 0.00 35.95 39.59 3k5t h PHE 650 CO 0.61 0.20 0.60 1.49 -2.23 0.00 0.00 178.31 178.98 3k5t h GLU 651 N 0.40 0.75 -0.34 1.11 4.57 -1.95 -1.92 114.58 117.20 3k5t h GLU 651 Ca 0.30 -0.05 -0.01 0.00 -1.18 0.00 0.00 59.36 58.43 3k5t h GLU 651 Cb 0.63 -0.17 -0.02 0.00 -0.16 0.00 0.00 28.75 29.03 3k5t h GLU 651 CO -0.08 0.50 0.18 1.96 -1.18 0.00 0.00 179.01 180.38 3k5t h GLN 652 N 0.77 0.46 -1.00 1.92 7.50 -1.53 -1.79 115.11 121.45 3k5t h GLN 652 Ca 0.48 -0.04 0.25 0.00 0.50 0.00 0.00 58.65 59.84 3k5t h GLN 652 Cb 0.70 -0.10 -0.08 0.00 0.05 0.00 0.00 27.48 28.06 3k5t h GLN 652 CO -0.24 0.35 0.66 0.74 -1.50 0.00 0.00 178.83 178.84 3k5t h PHE 653 N 0.47 0.50 0.00 2.96 0.04 -1.44 -0.53 116.94 118.94 3k5t h PHE 653 Ca 0.12 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.91 3k5t h PHE 653 Cb 0.03 -0.15 0.00 0.00 2.20 0.00 0.00 35.95 38.03 3k5t h PHE 653 CO 0.00 0.08 -0.35 1.28 -0.60 0.00 0.00 178.31 178.72 3k5t n LEU 654 N -4.51 0.36 -0.22 1.54 4.77 -0.68 -4.43 117.00 113.82 3k5t n LEU 654 Ca 0.23 0.15 -0.06 0.00 -0.03 0.00 0.00 56.01 56.30 3k5t n LEU 654 Cb 0.86 -0.32 0.04 0.00 -2.33 0.00 0.00 43.42 41.67 3k5t n LEU 654 CO 0.30 0.08 1.14 -0.74 -1.33 0.00 0.00 177.39 176.84 3k5t h HIS 655 N 0.00 0.80 0.00 -1.77 2.76 -1.12 0.31 115.15 116.13 3k5t h HIS 655 Ca 0.00 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.19 3k5t h HIS 655 Cb 0.50 -0.27 0.00 0.00 1.55 0.00 0.00 27.41 29.20 3k5t h HIS 655 CO 0.00 0.50 0.00 0.27 -1.30 0.00 0.00 177.93 177.40 3k5t n ASN 656 N -4.65 0.00 -2.95 3.26 0.23 -1.26 -4.92 115.26 104.98 3k5t n ASN 656 Ca 0.05 -0.82 -0.11 0.00 -0.53 0.00 0.00 54.58 53.17 3k5t n ASN 656 Cb 0.02 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.72 3k5t n ASN 656 CO 0.00 0.00 0.00 -3.20 -0.93 0.00 0.00 177.26 173.13 3k5t n ASN 657 N -0.98 -2.06 -4.86 0.53 5.15 0.10 -4.87 115.26 108.27 3k5t n ASN 657 Ca 0.18 -0.38 -0.31 0.00 -0.60 0.00 0.00 54.58 53.47 3k5t n ASN 657 Cb 0.08 -0.67 -0.02 0.00 -0.53 0.00 0.00 39.78 38.64 3k5t n ASN 657 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 3k5t s GLU 658 N -3.02 3.77 0.18 1.20 2.02 -1.26 -4.58 118.70 117.01 3k5t s GLU 658 Ca 0.02 0.74 -0.30 0.00 0.02 0.00 0.00 54.97 55.45 3k5t s GLU 658 Cb -0.00 -2.18 -0.08 0.00 0.10 0.00 0.00 34.13 31.97 3k5t s GLU 658 CO 0.38 -0.33 1.26 1.21 0.02 0.00 0.00 175.26 177.80 3k5t s ASN 659 N -3.55 6.98 -0.23 -0.19 3.84 -1.26 -0.49 114.94 120.03 3k5t s ASN 659 Ca 0.55 2.31 0.11 0.00 0.21 0.00 0.00 52.86 56.04 3k5t s ASN 659 Cb -0.10 -2.61 0.45 0.00 -0.55 0.00 0.00 41.25 38.44 3k5t s ASN 659 CO 0.40 -0.47 1.30 2.30 -2.79 0.00 0.00 177.10 177.84 3k5t n ILE 660 N 2.72 2.31 -3.11 -5.21 -5.35 0.16 -4.89 119.36 106.00 3k5t n ILE 660 Ca 0.06 -3.03 -0.41 0.00 -0.27 0.00 0.00 62.75 59.10 3k5t n ILE 660 Cb 0.44 -0.27 -0.06 0.00 -1.74 0.00 0.00 39.64 38.01 3k5t n ILE 660 CO 0.00 0.00 0.00 -1.61 -1.76 0.00 0.00 176.55 173.18 3k5t s GLU 661 N -3.22 4.04 -1.23 6.28 2.02 -1.26 -4.28 118.70 121.05 3k5t s GLU 661 Ca 0.40 0.47 -0.14 0.00 0.02 0.00 0.00 54.97 55.72 3k5t s GLU 661 Cb 0.38 -3.68 -0.00 0.00 0.10 0.00 0.00 34.13 30.93 3k5t s GLU 661 CO -0.04 -0.47 0.67 -1.71 0.02 0.00 0.00 175.26 173.73 3k5t n ASN 662 N 5.78 -3.50 -4.35 -0.19 5.15 -0.63 -4.98 115.26 112.54 3k5t n ASN 662 Ca -0.01 -1.01 -0.18 0.00 -0.60 0.00 0.00 54.58 52.78 3k5t n ASN 662 Cb 0.49 -3.26 -0.10 0.00 -0.53 0.00 0.00 39.78 36.38 3k5t n ASN 662 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 3k5t s GLU 663 N -6.21 1.41 -0.53 1.20 0.41 -0.07 -4.61 118.70 110.31 3k5t s GLU 663 Ca 0.30 -1.74 -0.26 0.00 -0.41 0.00 0.00 54.97 52.86 3k5t s GLU 663 Cb -0.11 -0.61 -0.04 0.00 -1.78 0.00 0.00 34.13 31.59 3k5t s GLU 663 CO 0.87 -0.15 2.10 0.34 -0.49 0.00 0.00 175.26 177.94 3k5t s ASP 664 N -3.34 4.95 0.19 -0.19 -1.08 -1.24 -1.29 116.67 114.67 3k5t s ASP 664 Ca 0.32 0.76 -0.07 0.00 -0.52 0.00 0.00 52.55 53.03 3k5t s ASP 664 Cb 0.07 -2.52 -0.06 0.00 -1.46 0.00 0.00 42.92 38.95 3k5t s ASP 664 CO 0.11 -2.55 0.47 -0.76 0.52 0.00 0.00 175.17 172.96 3k5t s LEU 665 N 10.28 4.21 -0.10 -1.34 1.43 -1.26 0.33 118.68 132.23 3k5t s LEU 665 Ca 0.82 0.75 0.01 0.00 -1.03 0.00 0.00 54.13 54.67 3k5t s LEU 665 Cb -0.16 -3.50 0.02 0.00 0.03 0.00 0.00 46.19 42.59 3k5t s LEU 665 CO 0.24 -0.02 -0.10 -0.69 0.23 0.00 0.00 176.35 176.01 3k5t s VAL 666 N -1.76 1.13 0.15 -1.59 1.01 0.14 -4.22 120.40 115.26 3k5t s VAL 666 Ca 0.44 -0.40 -0.13 0.00 0.00 0.00 0.00 61.98 61.89 3k5t s VAL 666 Cb -0.12 -1.09 -0.07 0.00 0.00 0.00 0.00 36.38 35.10 3k5t s VAL 666 CO 0.23 0.37 0.54 0.00 0.00 0.00 0.00 175.10 176.24 3k5t s ALA 667 N 1.28 3.59 -0.09 5.51 0.00 -0.48 -0.39 121.76 131.17 3k5t s ALA 667 Ca -0.03 -0.17 0.01 0.00 0.00 0.00 0.00 51.96 51.77 3k5t s ALA 667 Cb -0.14 -2.49 0.02 0.00 0.00 0.00 0.00 23.12 20.51 3k5t s ALA 667 CO -0.04 0.47 -0.09 -1.58 0.00 0.00 0.00 175.76 174.52 3k5t s TRP 668 N -1.50 1.45 -0.07 0.00 0.52 0.15 0.19 118.94 119.69 3k5t s TRP 668 Ca 0.38 -0.64 0.04 0.00 0.02 0.00 0.00 56.10 55.91 3k5t s TRP 668 Cb -0.14 -1.15 -0.00 0.00 -1.15 0.00 0.00 33.47 31.02 3k5t s TRP 668 CO 0.19 -0.41 -0.22 0.08 0.02 0.00 0.00 176.95 176.62 3k5t s VAL 669 N 1.25 1.84 -0.19 4.03 1.01 -0.69 -0.75 120.40 126.91 3k5t s VAL 669 Ca -0.04 -0.92 -0.05 0.00 0.00 0.00 0.00 61.98 60.98 3k5t s VAL 669 Cb -0.14 -1.58 -0.02 0.00 0.00 0.00 0.00 36.38 34.63 3k5t s VAL 669 CO -0.03 0.51 -0.01 -0.89 0.00 0.00 0.00 175.10 174.68 3k5t s THR 670 N 0.17 3.95 0.11 3.92 2.01 -1.01 -0.01 115.64 124.77 3k5t s THR 670 Ca -0.11 -0.32 0.06 0.00 0.31 0.00 0.00 61.69 61.63 3k5t s THR 670 Cb -0.15 -2.77 -0.03 0.00 0.01 0.00 0.00 72.50 69.55 3k5t s THR 670 CO 0.06 0.44 -0.14 0.68 -0.69 0.00 0.00 174.62 174.97 3k5t s VAL 671 N 0.86 1.26 -0.29 3.82 -7.23 -0.57 -4.63 120.40 113.63 3k5t s VAL 671 Ca 0.01 -1.59 0.00 0.00 -1.81 0.00 0.00 61.98 58.59 3k5t s VAL 671 Cb -0.14 -1.39 0.00 0.00 0.56 0.00 0.00 36.38 35.40 3k5t s VAL 671 CO 0.02 -0.35 0.00 0.61 -0.31 0.00 0.00 175.10 175.07 3k5t n GLY 672 N 0.77 -1.19 3.57 2.32 0.00 -1.26 0.61 105.19 110.02 3k5t n GLY 672 Ca -0.17 -1.02 -0.15 0.00 0.00 0.00 0.00 46.02 44.67 3k5t n GLY 672 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3k5t s PHE 673 N -2.03 -0.66 -0.16 1.61 -0.12 0.18 -0.13 117.98 116.67 3k5t s PHE 673 Ca 0.00 1.35 -0.29 0.00 -0.05 0.00 0.00 56.93 57.94 3k5t s PHE 673 Cb 0.00 0.36 -0.02 0.00 -0.63 0.00 0.00 43.02 42.74 3k5t s PHE 673 CO 0.00 -0.48 1.31 -1.17 -0.05 0.00 0.00 175.22 174.84 3k5t s LEU 674 N -0.54 4.17 -0.43 -1.99 2.96 -1.26 0.60 118.68 122.19 3k5t s LEU 674 Ca -0.05 1.71 -0.07 0.00 -0.22 0.00 0.00 54.13 55.50 3k5t s LEU 674 Cb -0.02 -3.54 0.10 0.00 0.50 0.00 0.00 46.19 43.23 3k5t s LEU 674 CO 0.05 -0.81 0.26 -2.28 -1.32 0.00 0.00 176.35 172.25 3k5t s HIS 675 N 3.65 3.43 -0.52 5.38 5.65 0.21 -4.96 115.29 128.13 3k5t s HIS 675 Ca 0.57 -1.89 -0.20 0.00 0.25 0.00 0.00 55.06 53.79 3k5t s HIS 675 Cb -0.23 -3.15 0.06 0.00 -1.18 0.00 0.00 32.58 28.08 3k5t s HIS 675 CO 0.17 -0.92 0.69 0.42 -0.65 0.00 0.00 174.74 174.44 3k5t s ILE 676 N 1.32 4.78 0.36 0.89 1.01 -1.26 -2.33 121.20 125.96 3k5t s ILE 676 Ca 0.05 -0.39 -0.25 0.00 0.00 0.00 0.00 60.65 60.06 3k5t s ILE 676 Cb -0.24 -4.36 -0.13 0.00 0.01 0.00 0.00 42.46 37.75 3k5t s ILE 676 CO -0.01 -0.89 0.86 -2.65 0.00 0.00 0.00 174.94 172.25 3k5t n PRO 677 N 6.43 1.05 -4.31 2.79 -0.02 -1.26 -5.02 135.00 134.66 3k5t n PRO 677 Ca -0.05 0.37 -0.16 0.00 -2.02 0.00 0.00 63.50 61.64 3k5t n PRO 677 Cb 0.46 -1.76 -0.10 0.00 -0.02 0.00 0.00 33.50 32.08 3k5t n PRO 677 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 3k5t s HIS 678 N -1.23 1.48 0.51 6.00 -3.43 -1.26 -4.54 115.29 112.82 3k5t s HIS 678 Ca 0.62 -1.04 0.25 0.00 -0.80 0.00 0.00 55.06 54.08 3k5t s HIS 678 Cb -0.65 -0.86 1.36 0.00 -1.43 0.00 0.00 32.58 31.00 3k5t s HIS 678 CO 0.58 -0.19 1.96 0.66 -2.00 0.00 0.00 174.74 175.76 3k5t h SER 679 N 2.48 0.06 0.52 7.38 4.64 -1.90 0.71 113.55 127.45 3k5t h SER 679 Ca -0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 3k5t h SER 679 Cb 1.23 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 3k5t h SER 679 CO 0.63 0.03 0.00 -0.33 -0.87 0.00 0.00 176.83 176.29 3k5t h GLU 680 N 0.07 0.00 0.00 4.77 3.07 -1.96 -2.18 114.58 118.34 3k5t h GLU 680 Ca 0.30 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.16 3k5t h GLU 680 Cb 1.11 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.02 3k5t h GLU 680 CO -0.02 0.00 0.00 -0.25 -1.40 0.00 0.00 179.01 177.34 3k5t n ASP 681 N -2.96 0.00 -4.45 1.42 8.00 0.24 -4.69 116.55 114.12 3k5t n ASP 681 Ca -0.01 -1.01 -0.34 0.00 0.71 0.00 0.00 54.79 54.14 3k5t n ASP 681 Cb 0.19 0.00 -0.13 0.00 -0.02 0.00 0.00 41.12 41.16 3k5t n ASP 681 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3k5t s ILE 682 N -2.00 3.83 -0.00 0.53 -1.09 -0.82 -2.31 121.20 119.33 3k5t s ILE 682 Ca 0.15 -0.36 0.25 0.00 -2.23 0.00 0.00 60.65 58.45 3k5t s ILE 682 Cb 0.07 -2.71 0.26 0.00 -1.58 0.00 0.00 42.46 38.50 3k5t s ILE 682 CO 0.11 0.46 1.77 1.55 -1.23 0.00 0.00 174.94 177.61 3k5t h PRO 683 N 7.19 0.00 -5.26 2.79 0.13 -1.83 -3.49 132.00 131.54 3k5t h PRO 683 Ca -0.34 0.00 -0.40 0.00 -0.87 0.00 0.00 66.00 64.40 3k5t h PRO 683 Cb 1.18 0.00 -0.21 0.00 0.13 0.00 0.00 31.00 32.10 3k5t h PRO 683 CO 0.61 0.18 -0.77 -0.80 -0.23 0.00 0.00 178.00 176.99 3k5t s ASN 684 N -6.12 1.60 0.21 1.44 0.02 -0.98 -4.60 114.94 106.51 3k5t s ASN 684 Ca 0.02 -0.63 -0.31 0.00 -1.02 0.00 0.00 52.86 50.92 3k5t s ASN 684 Cb 0.09 -0.04 -0.11 0.00 0.02 0.00 0.00 41.25 41.21 3k5t s ASN 684 CO 0.64 -0.10 1.59 -0.89 0.02 0.00 0.00 177.10 178.36 3k5t s THR 685 N -1.37 2.40 0.03 1.60 2.01 -0.01 -4.33 115.64 115.97 3k5t s THR 685 Ca -0.02 0.30 -0.10 0.00 0.31 0.00 0.00 61.69 62.18 3k5t s THR 685 Cb -0.09 -3.19 -0.05 0.00 0.01 0.00 0.00 72.50 69.17 3k5t s THR 685 CO 0.02 0.03 0.35 0.00 -0.69 0.00 0.00 174.62 174.33 3k5t s ALA 686 N 0.80 3.76 0.29 7.40 0.00 -1.26 -3.25 121.76 129.50 3k5t s ALA 686 Ca 0.68 -0.41 0.13 0.00 0.00 0.00 0.00 51.96 52.36 3k5t s ALA 686 Cb -0.45 -2.22 0.53 0.00 0.00 0.00 0.00 23.12 20.97 3k5t s ALA 686 CO 0.36 0.57 1.70 1.79 0.00 0.00 0.00 175.76 180.18 3k5t h THR 687 N 3.20 1.30 -1.62 0.00 1.35 -1.91 -3.40 112.91 111.82 3k5t h THR 687 Ca -0.50 -1.76 -0.69 0.00 -0.55 0.00 0.00 66.41 62.90 3k5t h THR 687 Cb 1.20 1.97 0.01 0.00 -1.73 0.00 0.00 68.15 69.60 3k5t h THR 687 CO 0.64 0.49 1.04 -2.65 -0.25 0.00 0.00 175.52 174.80 3k5t n PRO 688 N -3.85 1.46 -0.96 4.72 -0.02 -1.26 0.45 135.00 135.54 3k5t n PRO 688 Ca -0.01 0.52 0.00 0.00 -2.02 0.00 0.00 63.50 61.99 3k5t n PRO 688 Cb 0.53 -2.32 0.00 0.00 -0.02 0.00 0.00 33.50 31.69 3k5t n PRO 688 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3k5t n GLY 689 N 4.62 0.32 2.66 -1.23 0.00 -1.26 -4.89 105.19 105.40 3k5t n GLY 689 Ca 0.28 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.97 3k5t n GLY 689 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3k5t n ASN 690 N -0.38 5.87 -4.01 1.61 3.02 0.17 -4.98 115.26 116.56 3k5t n ASN 690 Ca 0.00 -3.77 -0.12 0.00 -0.03 0.00 0.00 54.58 50.66 3k5t n ASN 690 Cb 0.19 -0.71 -0.12 0.00 -0.61 0.00 0.00 39.78 38.53 3k5t n ASN 690 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 3k5t s SER 691 N -2.54 0.57 0.23 6.41 1.04 -1.26 -1.50 113.70 116.65 3k5t s SER 691 Ca 0.50 -0.43 0.00 0.00 0.48 0.00 0.00 55.95 56.50 3k5t s SER 691 Cb 0.42 0.04 -0.04 0.00 0.10 0.00 0.00 66.02 66.53 3k5t s SER 691 CO -0.28 -0.18 0.13 0.68 0.98 0.00 0.00 173.24 174.56 3k5t s VAL 692 N -1.13 0.20 -4.11 5.02 -7.23 -0.76 -4.94 120.40 107.45 3k5t s VAL 692 Ca -0.09 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.08 3k5t s VAL 692 Cb -0.08 -2.55 0.00 0.00 0.56 0.00 0.00 36.38 34.31 3k5t s VAL 692 CO -0.00 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.40 3k5t n GLY 693 N -0.36 -0.50 3.45 2.32 0.00 -0.23 -0.79 105.19 109.08 3k5t n GLY 693 Ca 0.01 -0.71 -0.13 0.00 0.00 0.00 0.00 46.02 45.19 3k5t n GLY 693 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3k5t s PHE 694 N -4.00 -0.54 -0.04 1.61 -0.12 -0.49 0.57 117.98 114.98 3k5t s PHE 694 Ca 0.00 0.49 0.02 0.00 -0.05 0.00 0.00 56.93 57.39 3k5t s PHE 694 Cb 0.00 0.52 -0.03 0.00 -0.63 0.00 0.00 43.02 42.88 3k5t s PHE 694 CO 0.00 -0.75 -0.07 -0.51 -0.05 0.00 0.00 175.22 173.84 3k5t s LEU 695 N -2.35 3.18 -0.24 -1.99 1.43 0.25 -0.58 118.68 118.38 3k5t s LEU 695 Ca -0.01 -0.07 -0.07 0.00 -1.03 0.00 0.00 54.13 52.96 3k5t s LEU 695 Cb -0.01 -1.75 -0.02 0.00 0.03 0.00 0.00 46.19 44.44 3k5t s LEU 695 CO -0.07 0.33 0.05 -0.76 0.23 0.00 0.00 176.35 176.12 3k5t s LEU 696 N -1.06 3.34 -0.06 1.79 1.43 0.12 -0.91 118.68 123.32 3k5t s LEU 696 Ca 0.14 -0.24 0.06 0.00 -1.03 0.00 0.00 54.13 53.06 3k5t s LEU 696 Cb -0.11 -1.89 -0.01 0.00 0.03 0.00 0.00 46.19 44.21 3k5t s LEU 696 CO 0.04 -0.03 -0.23 -0.13 0.23 0.00 0.00 176.35 176.23 3k5t s ARG 697 N 1.58 2.39 0.30 1.70 0.52 -0.34 -1.37 118.95 123.73 3k5t s ARG 697 Ca 0.06 -0.83 -0.30 0.00 -0.52 0.00 0.00 55.73 54.14 3k5t s ARG 697 Cb -0.15 -2.02 -0.12 0.00 0.52 0.00 0.00 34.95 33.18 3k5t s ARG 697 CO 0.02 0.33 1.56 -2.30 0.02 0.00 0.00 175.30 174.94 3k5t n PRO 698 N 3.04 2.63 -3.68 3.54 -0.02 -1.26 -0.59 135.00 138.66 3k5t n PRO 698 Ca -0.18 0.93 -0.29 0.00 -2.02 0.00 0.00 63.50 61.95 3k5t n PRO 698 Cb 0.52 -2.69 -0.15 0.00 -0.02 0.00 0.00 33.50 31.15 3k5t n PRO 698 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 3k5t s PHE 699 N -0.14 1.09 -1.53 6.00 5.36 0.23 -4.77 117.98 124.22 3k5t s PHE 699 Ca 0.63 -1.22 0.00 0.00 -0.96 0.00 0.00 56.93 55.38 3k5t s PHE 699 Cb -0.51 -1.28 0.00 0.00 -0.34 0.00 0.00 43.02 40.89 3k5t s PHE 699 CO 0.50 -0.78 0.00 0.09 -1.46 0.00 0.00 175.22 173.57 3k5t n ASN 700 N 5.03 -4.27 0.07 6.13 3.02 -1.26 -1.20 115.26 122.77 3k5t n ASN 700 Ca -0.05 0.29 -0.11 0.00 -0.03 0.00 0.00 54.58 54.67 3k5t n ASN 700 Cb 0.44 -3.79 -0.13 0.00 -0.61 0.00 0.00 39.78 35.69 3k5t n ASN 700 CO 0.00 0.00 0.00 0.15 -2.62 0.00 0.00 177.26 174.79 3k5t h PHE 701 N 0.00 0.23 -3.39 3.10 3.04 -1.83 -3.34 116.94 114.75 3k5t h PHE 701 Ca -0.33 -0.16 -0.66 0.00 3.98 0.00 0.00 57.97 60.79 3k5t h PHE 701 Cb 1.10 -0.01 -0.19 0.00 2.56 0.00 0.00 35.95 39.41 3k5t h PHE 701 CO 0.51 1.15 -0.82 -0.06 -2.02 0.00 0.00 178.31 177.07 3k5t s PHE 702 N -2.67 2.38 0.29 0.41 0.40 -1.26 -4.90 117.98 112.63 3k5t s PHE 702 Ca -0.03 -0.33 0.19 0.00 -0.60 0.00 0.00 56.93 56.17 3k5t s PHE 702 Cb 0.08 -1.21 0.90 0.00 0.51 0.00 0.00 43.02 43.30 3k5t s PHE 702 CO 0.85 0.45 1.85 -1.35 0.70 0.00 0.00 175.22 177.72 3k5t h PRO 703 N 3.38 0.00 -3.20 0.24 0.11 -2.01 -3.46 132.00 127.06 3k5t h PRO 703 Ca -0.48 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.55 3k5t h PRO 703 Cb 1.19 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.30 3k5t h PRO 703 CO 0.47 0.30 0.20 -1.83 -0.21 0.00 0.00 178.00 176.93 3k5t s GLU 704 N -3.94 2.25 -0.48 1.05 -1.05 -1.26 -4.96 118.70 110.31 3k5t s GLU 704 Ca -0.02 -1.55 -0.37 0.00 -0.15 0.00 0.00 54.97 52.88 3k5t s GLU 704 Cb 0.13 0.60 -0.15 0.00 -0.44 0.00 0.00 34.13 34.26 3k5t s GLU 704 CO 0.67 -1.04 2.24 -3.47 0.95 0.00 0.00 175.26 174.61 3k5t n ASP 705 N -1.55 1.45 0.00 0.83 -0.08 -1.26 -4.81 116.55 111.13 3k5t n ASP 705 Ca -0.07 0.43 0.05 0.00 -1.51 0.00 0.00 54.79 53.69 3k5t n ASP 705 Cb 0.60 -1.11 0.29 0.00 2.34 0.00 0.00 41.12 43.23 3k5t n ASP 705 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 3k5t n PRO 706 N 8.03 0.25 0.00 -0.67 -0.04 -1.26 -1.87 135.00 139.44 3k5t n PRO 706 Ca 0.49 0.08 0.14 0.00 -0.04 0.00 0.00 63.50 64.16 3k5t n PRO 706 Cb 0.13 -1.50 0.52 0.00 -0.04 0.00 0.00 33.50 32.61 3k5t n PRO 706 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 3k5t n SER 707 N -1.12 0.99 0.26 3.54 3.41 -1.26 -3.81 113.62 115.64 3k5t n SER 707 Ca 0.07 -1.04 0.12 0.00 -0.26 0.00 0.00 58.87 57.76 3k5t n SER 707 Cb 0.05 0.03 0.73 0.00 -0.26 0.00 0.00 64.21 64.76 3k5t n SER 707 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3k5t h LEU 708 N 1.38 0.00 -2.67 1.04 3.38 -1.74 -1.36 115.31 115.33 3k5t h LEU 708 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3k5t h LEU 708 Cb 0.44 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.19 3k5t h LEU 708 CO 0.00 0.11 0.00 0.00 0.09 0.00 0.00 178.44 178.64 3k5t h ALA 709 N 1.89 1.00 -2.40 1.53 0.00 -1.82 -3.44 119.26 116.02 3k5t h ALA 709 Ca -0.00 0.00 -0.54 0.00 0.00 0.00 0.00 54.91 54.37 3k5t h ALA 709 Cb 0.28 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 3k5t h ALA 709 CO 0.01 0.00 0.69 0.45 0.00 0.00 0.00 179.25 180.40 3k5t s SER 710 N -4.95 7.00 0.00 0.00 0.15 -0.52 -4.92 113.70 110.46 3k5t s SER 710 Ca -0.04 1.99 0.27 0.00 0.70 0.00 0.00 55.95 58.86 3k5t s SER 710 Cb 0.12 -2.57 1.24 0.00 -1.71 0.00 0.00 66.02 63.10 3k5t s SER 710 CO 0.37 -0.58 1.84 0.54 1.20 0.00 0.00 173.24 176.61 3k5t n ARG 711 N 4.73 1.41 0.22 5.44 5.12 -1.26 -3.58 116.66 128.75 3k5t n ARG 711 Ca 0.11 -0.60 0.15 0.00 -1.93 0.00 0.00 57.85 55.58 3k5t n ARG 711 Cb 0.45 -1.45 0.68 0.00 -1.16 0.00 0.00 32.46 30.99 3k5t n ARG 711 CO 0.00 0.00 0.00 -0.44 -1.93 0.00 0.00 177.63 175.26 3k5t h ASP 712 N 1.39 0.00 -4.07 0.55 3.32 -1.91 -3.05 116.42 112.64 3k5t h ASP 712 Ca 0.00 0.00 -0.55 0.00 0.02 0.00 0.00 57.03 56.50 3k5t h ASP 712 Cb 0.30 0.00 0.14 0.00 0.22 0.00 0.00 39.33 39.99 3k5t h ASP 712 CO 0.00 0.00 0.58 -0.89 -1.72 0.00 0.00 179.24 177.21 3k5t s THR 713 N -3.60 2.04 -0.06 0.35 2.01 -1.23 -4.67 115.64 110.48 3k5t s THR 713 Ca 0.01 0.03 0.00 0.00 0.31 0.00 0.00 61.69 62.04 3k5t s THR 713 Cb 0.09 -3.01 0.02 0.00 0.01 0.00 0.00 72.50 69.61 3k5t s THR 713 CO 0.43 -0.00 -0.04 -0.69 -0.69 0.00 0.00 174.62 173.63 3k5t s VAL 714 N -1.32 0.54 -0.11 3.82 1.01 -0.81 -4.26 120.40 119.27 3k5t s VAL 714 Ca 0.75 -0.09 0.03 0.00 0.00 0.00 0.00 61.98 62.67 3k5t s VAL 714 Cb -0.40 -0.60 0.01 0.00 0.00 0.00 0.00 36.38 35.39 3k5t s VAL 714 CO 0.46 0.24 -0.19 -0.63 0.00 0.00 0.00 175.10 174.98 3k5t s ILE 715 N 1.20 1.73 -0.17 2.22 1.01 -0.75 -1.67 121.20 124.77 3k5t s ILE 715 Ca -0.07 -0.80 -0.06 0.00 0.00 0.00 0.00 60.65 59.72 3k5t s ILE 715 Cb -0.14 -1.54 -0.04 0.00 0.01 0.00 0.00 42.46 40.75 3k5t s ILE 715 CO -0.02 0.49 0.04 -0.69 0.00 0.00 0.00 174.94 174.76 3k5t s VAL 716 N 0.72 4.58 -0.04 2.92 1.01 0.07 0.03 120.40 129.69 3k5t s VAL 716 Ca -0.11 -0.11 0.02 0.00 0.00 0.00 0.00 61.98 61.78 3k5t s VAL 716 Cb -0.16 -3.05 -0.03 0.00 0.00 0.00 0.00 36.38 33.14 3k5t s VAL 716 CO 0.02 0.47 -0.09 0.26 0.00 0.00 0.00 175.10 175.76 3k5t s TRP 717 N 0.33 2.85 0.44 5.22 0.52 -0.77 -2.12 118.94 125.41 3k5t s TRP 717 Ca 0.02 -0.05 -0.23 0.00 0.02 0.00 0.00 56.10 55.86 3k5t s TRP 717 Cb -0.13 -1.66 -0.08 0.00 -1.15 0.00 0.00 33.47 30.45 3k5t s TRP 717 CO 0.01 0.30 1.08 -1.25 0.02 0.00 0.00 176.95 177.10 3k5t s PRO 718 N -0.95 3.95 -0.06 4.98 0.04 -1.26 -2.07 135.00 139.63 3k5t s PRO 718 Ca 0.13 1.54 -0.05 0.00 0.04 0.00 0.00 61.00 62.66 3k5t s PRO 718 Cb -0.11 -2.38 0.02 0.00 0.04 0.00 0.00 34.50 32.06 3k5t s PRO 718 CO 0.03 -0.33 0.15 1.03 0.04 0.00 0.00 177.00 177.92 3k5t s ARG 719 N -2.75 0.18 0.18 4.56 1.81 -1.26 -4.83 118.95 116.84 3k5t s ARG 719 Ca 0.62 0.22 0.10 0.00 -1.72 0.00 0.00 55.73 54.95 3k5t s ARG 719 Cb -0.22 0.08 -0.10 0.00 -0.45 0.00 0.00 34.95 34.26 3k5t s ARG 719 CO 0.27 -0.03 1.35 -0.44 -0.68 0.00 0.00 175.30 175.77 3k5t h ASP 720 N 5.96 0.00 0.00 0.23 5.19 -1.97 -3.42 116.42 122.42 3k5t h ASP 720 Ca -0.26 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.15 3k5t h ASP 720 Cb 1.20 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.71 3k5t h ASP 720 CO 0.41 0.80 -0.28 0.59 -3.12 0.00 0.00 179.24 177.64 3k5t n ASN 721 N -3.30 0.95 0.00 6.45 4.13 -1.26 -5.09 115.26 117.14 3k5t n ASN 721 Ca 0.01 0.43 0.00 0.00 1.68 0.00 0.00 54.58 56.70 3k5t n ASN 721 Cb 0.86 -0.69 0.00 0.00 -1.54 0.00 0.00 39.78 38.41 3k5t n ASN 721 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3k5t n GLY 722 N 1.66 5.35 3.76 7.41 0.00 -1.26 -5.09 105.19 117.03 3k5t n GLY 722 Ca -0.04 -1.38 -0.41 0.00 0.00 0.00 0.00 46.02 44.19 3k5t n GLY 722 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3k5t s PRO 723 N 4.08 4.23 0.77 1.61 0.04 -1.26 -4.80 135.00 139.66 3k5t s PRO 723 Ca 0.00 2.39 -0.15 0.00 0.04 0.00 0.00 61.00 63.29 3k5t s PRO 723 Cb 0.00 -3.04 0.06 0.00 0.04 0.00 0.00 34.50 31.56 3k5t s PRO 723 CO 0.00 -0.40 1.21 0.09 0.04 0.00 0.00 177.00 177.94 3k5t n ASN 724 N 1.22 1.24 -4.51 6.66 3.02 -1.26 -4.83 115.26 116.81 3k5t n ASN 724 Ca 0.03 0.65 -0.42 0.00 -0.03 0.00 0.00 54.58 54.80 3k5t n ASN 724 Cb 0.40 -1.52 -0.03 0.00 -0.61 0.00 0.00 39.78 38.02 3k5t n ASN 724 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 3k5t s TYR 725 N -1.94 2.60 -0.94 3.10 5.04 -0.88 -4.89 117.35 119.44 3k5t s TYR 725 Ca 0.76 -0.61 -0.24 0.00 -2.44 0.00 0.00 57.07 54.54 3k5t s TYR 725 Cb -0.31 -4.49 0.01 0.00 0.35 0.00 0.00 41.96 37.51 3k5t s TYR 725 CO 0.48 -1.82 1.66 0.08 -1.34 0.00 0.00 175.55 174.61 3k5t s VAL 726 N 4.55 3.69 0.04 3.14 1.01 -1.26 -1.84 120.40 129.73 3k5t s VAL 726 Ca 0.33 -0.50 -0.30 0.00 0.00 0.00 0.00 61.98 61.51 3k5t s VAL 726 Cb -0.08 -4.57 -0.04 0.00 0.00 0.00 0.00 36.38 31.68 3k5t s VAL 726 CO 0.04 -1.48 1.04 -1.58 0.00 0.00 0.00 175.10 173.12 3k5t s GLN 727 N 5.94 4.54 0.08 2.72 0.74 0.10 -4.95 119.66 128.84 3k5t s GLN 727 Ca 0.56 1.54 -0.04 0.00 0.05 0.00 0.00 55.36 57.47 3k5t s GLN 727 Cb -0.04 -3.41 -0.03 0.00 1.10 0.00 0.00 33.01 30.64 3k5t s GLN 727 CO -0.04 -0.07 0.07 1.03 -0.55 0.00 0.00 175.29 175.73 3k5t s ARG 728 N 0.83 0.76 0.00 1.67 0.52 -1.26 -1.81 118.95 119.66 3k5t s ARG 728 Ca 0.53 -1.17 0.00 0.00 -0.52 0.00 0.00 55.73 54.57 3k5t s ARG 728 Cb -0.24 0.26 0.00 0.00 0.52 0.00 0.00 34.95 35.49 3k5t s ARG 728 CO 0.29 -0.20 0.04 0.91 0.02 0.00 0.00 175.30 176.37 3k5t n TRP 729 N 0.01 0.00 -5.03 -0.53 8.01 -1.25 -4.97 117.44 113.68 3k5t n TRP 729 Ca -0.13 0.00 -0.27 0.00 -1.31 0.00 0.00 57.50 55.79 3k5t n TRP 729 Cb 0.62 0.00 -0.16 0.00 -2.01 0.00 0.00 31.31 29.76 3k5t n TRP 729 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.69 177.10 3k5t s ILE 730 N -0.40 1.68 0.45 -0.99 1.01 -1.15 -4.93 121.20 116.87 3k5t s ILE 730 Ca 0.00 -0.92 -0.24 0.00 0.00 0.00 0.00 60.65 59.48 3k5t s ILE 730 Cb 0.00 -1.40 -0.08 0.00 0.01 0.00 0.00 42.46 41.00 3k5t s ILE 730 CO 0.00 0.46 1.27 -2.16 0.00 0.00 0.00 174.94 174.52 3k5t s PRO 731 N -0.53 3.74 0.22 2.79 0.04 -1.26 -4.93 135.00 135.06 3k5t s PRO 731 Ca 0.08 2.06 -0.32 0.00 0.04 0.00 0.00 61.00 62.87 3k5t s PRO 731 Cb -0.08 -2.56 -0.14 0.00 0.04 0.00 0.00 34.50 31.76 3k5t s PRO 731 CO -0.01 -0.65 1.32 -1.91 0.04 0.00 0.00 177.00 175.80 3k5t n GLU 732 N -0.28 1.75 -4.50 4.56 2.13 -1.26 -4.97 120.64 118.06 3k5t n GLU 732 Ca 0.06 0.62 -0.22 0.00 0.66 0.00 0.00 57.16 58.28 3k5t n GLU 732 Cb 0.45 -2.22 -0.14 0.00 0.27 0.00 0.00 31.44 29.80 3k5t n GLU 732 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 3k5t s ASP 733 N 0.19 1.91 0.00 4.31 2.15 -1.26 -5.02 116.67 118.95 3k5t s ASP 733 Ca 0.70 -0.44 0.18 0.00 0.43 0.00 0.00 52.55 53.42 3k5t s ASP 733 Cb -0.71 -0.15 0.31 0.00 -0.30 0.00 0.00 42.92 42.06 3k5t s ASP 733 CO 0.51 0.10 1.11 0.54 -0.17 0.00 0.00 175.17 177.25 3k5t n ARG 734 N 2.05 0.00 -1.76 4.34 1.74 -1.26 -5.12 116.66 116.64 3k5t n ARG 734 Ca -0.17 -1.69 -0.33 0.00 -0.77 0.00 0.00 57.85 54.89 3k5t n ARG 734 Cb 0.54 -0.03 0.05 0.00 -1.02 0.00 0.00 32.46 32.00 3k5t n ARG 734 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3k5t s ASP 735 N -1.69 5.07 0.02 0.55 1.11 -1.26 -5.04 116.67 115.43 3k5t s ASP 735 Ca 0.24 2.04 0.05 0.00 0.18 0.00 0.00 52.55 55.07 3k5t s ASP 735 Cb 0.28 -2.56 -0.03 0.00 1.07 0.00 0.00 42.92 41.68 3k5t s ASP 735 CO -0.12 -1.66 -0.13 0.00 1.18 0.00 0.00 175.17 174.45 3k5t s SER 737 N -1.37 0.96 -0.03 0.00 1.04 -1.26 -4.87 113.70 108.17 3k5t s SER 737 Ca 0.15 -1.51 0.01 0.00 0.48 0.00 0.00 55.95 55.08 3k5t s SER 737 Cb -0.11 0.70 0.02 0.00 0.10 0.00 0.00 66.02 66.73 3k5t s SER 737 CO 0.06 -1.36 -0.00 -0.32 0.98 0.00 0.00 173.24 172.59 3k5t s MET 738 N -2.87 0.32 0.67 4.02 1.75 -1.26 -4.94 119.30 117.00 3k5t s MET 738 Ca 0.30 0.05 -0.12 0.00 -1.25 0.00 0.00 55.69 54.67 3k5t s MET 738 Cb -0.01 -0.48 -0.00 0.00 2.84 0.00 0.00 34.83 37.18 3k5t s MET 738 CO 0.21 -0.12 1.06 -1.25 -0.65 0.00 0.00 175.02 174.27 3k5t s PRO 739 N 0.94 3.00 0.69 4.11 0.04 -1.26 -5.01 135.00 137.50 3k5t s PRO 739 Ca -0.10 1.04 -0.15 0.00 0.04 0.00 0.00 61.00 61.83 3k5t s PRO 739 Cb -0.13 -2.00 0.02 0.00 0.04 0.00 0.00 34.50 32.43 3k5t s PRO 739 CO -0.01 -1.06 1.16 -1.25 0.04 0.00 0.00 177.00 175.87 3k5t s PRO 740 N -4.77 2.51 0.58 0.56 0.04 -1.26 -4.93 135.00 127.72 3k5t s PRO 740 Ca 0.60 1.57 -0.19 0.00 0.04 0.00 0.00 61.00 63.02 3k5t s PRO 740 Cb -0.15 -1.90 -0.04 0.00 0.04 0.00 0.00 34.50 32.45 3k5t s PRO 740 CO 0.50 -1.51 1.16 -2.14 0.04 0.00 0.00 177.00 175.05 3k5t s PRO 741 N -3.97 3.11 0.33 0.56 0.02 -1.26 -4.92 135.00 128.87 3k5t s PRO 741 Ca 0.71 1.69 -0.28 0.00 0.02 0.00 0.00 61.00 63.14 3k5t s PRO 741 Cb -0.25 -1.96 -0.13 0.00 0.02 0.00 0.00 34.50 32.18 3k5t s PRO 741 CO 0.43 -1.06 1.15 0.34 -0.33 0.00 0.00 177.00 177.52 3k5t n PHE 742 N -1.56 1.76 -3.62 6.54 7.35 -1.26 -5.02 117.46 121.65 3k5t n PHE 742 Ca 0.12 0.61 -0.11 0.00 -0.76 0.00 0.00 57.45 57.32 3k5t n PHE 742 Cb 0.50 -2.33 -0.05 0.00 0.35 0.00 0.00 39.48 37.96 3k5t n PHE 742 CO 0.00 0.00 0.00 -1.54 -0.76 0.00 0.00 176.76 174.46 3k5t s SER 743 N -0.46 -0.26 -0.30 -2.13 1.04 -1.26 -5.16 113.70 105.17 3k5t s SER 743 Ca 0.58 -0.25 -0.06 0.00 0.48 0.00 0.00 55.95 56.70 3k5t s SER 743 Cb -0.62 0.47 0.15 0.00 0.10 0.00 0.00 66.02 66.13 3k5t s SER 743 CO 0.61 -0.83 0.62 -0.47 0.98 0.00 0.00 173.24 174.15 3k5t s TYR 744 N -3.59 -1.45 -0.11 5.02 5.04 -1.26 -4.62 117.35 116.38 3k5t s TYR 744 Ca 0.02 2.05 -0.19 0.00 -2.44 0.00 0.00 57.07 56.51 3k5t s TYR 744 Cb 0.01 0.70 -0.16 0.00 0.35 0.00 0.00 41.96 42.86 3k5t s TYR 744 CO -0.11 -0.76 0.54 -0.97 -1.34 0.00 0.00 175.55 172.92 3k5t h ASN 745 N 8.00 -0.02 0.00 4.32 -0.73 -1.97 -3.48 115.58 121.70 3k5t h ASN 745 Ca -0.20 -0.59 0.00 0.00 1.87 0.00 0.00 56.30 57.38 3k5t h ASN 745 Cb 1.13 0.01 0.00 0.00 0.27 0.00 0.00 38.32 39.72 3k5t h ASN 745 CO 0.17 0.76 0.00 0.61 -0.37 0.00 0.00 177.43 178.59 3k5t n GLY 746 N 1.52 2.17 3.77 1.57 0.00 -1.26 -5.02 105.19 107.95 3k5t n GLY 746 Ca -0.06 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.73 3k5t n GLY 746 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3k5t s THR 747 N -3.33 3.70 -0.41 2.61 -4.23 -1.26 -5.03 115.64 107.69 3k5t s THR 747 Ca 0.00 -1.57 0.05 0.00 -1.18 0.00 0.00 61.69 58.99 3k5t s THR 747 Cb 0.00 -3.14 0.17 0.00 1.34 0.00 0.00 72.50 70.87 3k5t s THR 747 CO 0.00 -0.28 0.47 -0.72 -0.54 0.00 0.00 174.62 173.56 3k5t s TYR 748 N -2.28 -0.56 0.45 3.99 -0.85 -1.26 -4.63 117.35 112.21 3k5t s TYR 748 Ca 0.36 -0.83 0.04 0.00 -0.52 0.00 0.00 57.07 56.12 3k5t s TYR 748 Cb -0.06 -0.23 -0.05 0.00 0.38 0.00 0.00 41.96 42.00 3k5t s TYR 748 CO 0.24 -1.04 0.01 1.03 -1.52 0.00 0.00 175.55 174.27 3k5t s ARG 749 N 1.20 2.05 0.87 -3.49 1.81 -1.22 -4.66 118.95 115.50 3k5t s ARG 749 Ca 0.21 -2.23 -0.11 0.00 -1.72 0.00 0.00 55.73 51.89 3k5t s ARG 749 Cb -0.08 -1.54 0.11 0.00 -0.45 0.00 0.00 34.95 32.99 3k5t s ARG 749 CO -0.06 -0.20 1.09 -2.14 -0.68 0.00 0.00 175.30 173.32 3k5t s PRO 750 N -3.79 1.50 0.00 3.54 0.02 -1.26 0.44 135.00 135.45 3k5t s PRO 750 Ca 0.22 1.03 0.00 0.00 0.02 0.00 0.00 61.00 62.28 3k5t s PRO 750 Cb 0.06 -1.82 0.00 0.00 0.02 0.00 0.00 34.50 32.76 3k5t s PRO 750 CO 0.12 -2.14 0.21 0.28 -0.33 0.00 0.00 177.00 175.14